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  • Springer  (351,215)
  • American Geophysical Union  (42,705)
  • International Union of Crystallography  (34,535)
  • Essen : Verl. Glückauf
  • Krefeld : Geologischer Dienst Nordhein-Westfalen
  • 2020-2022  (126,810)
  • 2005-2009  (286,136)
  • 1940-1944  (15,512)
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  • 1
    Publication Date: 2021-01-04
    Description: In the last years, monitoring systems based on low-cost and miniaturized sensors (MEMS) revealed as a very successful compromise between the availability of data and their quality. Also applications in the field of seismic and structural monitoring have been constantly increasing in term of number and variety of functions. Among these applications, the implementation of systems for earthquake early warning is a cuttingedge topic, mainly for its relevance for the society as millions of peoples in various regions of the world are exposed to high seismic hazard. This paper introduces the optimization of an already established seismic (and structural) monitoring system, that would make it suitable for the implementation of the earthquake early warning. In particular, the sampling code has been improved and a new triggering algorithm able to automatically detect the ground shaking due to the propagation of the seismic waves has been developed. The preliminary results indicate that the system is very flexible and easy to implement, and encourage to perform further developing steps.
    Description: Published
    Description: 963-975
    Description: Cagliari
    Description: 5T. Sismologia, geofisica e geologia per l'ingegneria sismica
    Keywords: Seismic monitoring · Structural monitoring · MEMS · Earthquake early warning · Trigger algorithm
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: book chapter
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  • 2
    Publication Date: 2021-01-18
    Description: The aim of this paper is to identify the ground motion models (GMMs), applicable in active shallow crustal regions (ASCRs) and subduction zones (SZs), to be used for the new release of the seismic hazard model of Italy (MPS19) for peak ground acceleration and 12 ordinates of the acceleration response spectra (5% damping) in the period range 0.05–4 s. The steps to achieve such goal are: (1) a pre-selection of the GMMs that takes into account the suitability for the application to the Italian territory and the fulfillment of the new hazard model requirements; (2) the assessment of a proper scoring of the pre-selected GMMs using strong-motion data recorded in Italy; (3) the selection of the GMMs to be used in the hazard calculation. The final set of GMMs describes satisfactorily the epistemic uncertainty of the ground shaking process, privileging the simplicity and flexibility of the functional form. Finally, the weights of the selected GMMs are assigned combining the results of the scoring and the weights obtained through an experts’ elicitation.
    Description: Published
    Description: 3487–3516
    Description: 6T. Studi di pericolosità sismica e da maremoto
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 3
    Publication Date: 2021-01-22
    Description: Seismic refraction, multichannel analysis of surface waves (MASW) and ambient noise array measurements using the wireless array analysis (WARAN) system were applied to acquire near-surface profiles of seismic velocities in the Selinunte Archaeological Park. This ancient city is famous for numerous temples, which according to the literature, were destroyed by at least two earthquakes in antiquity. The morphology of the archeological park is affected by two rivers which in combination with the temple remains suggests three study sites. We determined the subsurface velocity at these three locations as essential information for further studies of the response of the temple structures to earthquake ground motions. The stratigraphy of the site indicates that low-velocity layers might exist. Seismic refraction profiles with 69 m spread and 24 geophones were employed during the active seismic experiments. The measured P-wave velocities of the top two layers were used as a constraint during the inversion of dispersion relations from the MASW and WARAN data. The reliability of the velocity profiles was tested by forward calculation of synthetic seismograms. P-wave velocities which were not well constraint throughout the dispersion curve inversions were adjusted through suitable Poisson’s ratios based on the well constraint S-velocities. The combined use of the three different kinds of measurements and multi-mode interpretation of the dispersion curves revealed velocity profiles including lowvelocity layers which are supported by de-amplification observed in ratios of horizontal and vertical components of noise spectra.
    Description: Published
    Description: 753–776
    Description: 7A. Geofisica per il monitoraggio ambientale
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 4
    Publication Date: 2021-02-02
    Description: Mapping the static gravity field in the Italian area is fundamental to identify the main lithospheric structures, to delineate the main geological elements at regional level and to infer the regional geodynamic setting. The ongoing tectonic processes highlight nevertheless the need to measure and model the time-variable gravity field, namely the dynamic gravity field, which requires increased accuracy and long time series of observations to separate the secular from the short-term variable components. The first, with a minor impact in Italy, are due to variations of ice mass balance (the viscoelastic response of the Earth to past changes in ice mass loading, and the elastic response of the Earth to present-day deglaciation), and the sealevel rise; the second are due to space/time variations of underground mass distributions, such as those related to seismic deformations, volcanic dynamics/eruptions and water transfer. Local-scale gravity studies along seismogenic faults may provide useful hints to study the seismic cycle and to unravel those areas more prone to seismic release by studying if the crustal volume is undergoing dilatancy (gravity decrease) or overpressure (gravity increase) before earthquake occurrence. This process, however, is accompanied by possible fluid migration, which can be revealed by other geophysical measurements, for example, by magnetotelluric and geoelectrical surveys. In this short paper, we briefly summarize the main sources of gravity variation providing on the same time orders of magnitude, spatial and temporal scales of their effects.
    Description: Published
    Description: 549-558
    Description: 2T. Deformazione crostale attiva
    Description: JCR Journal
    Keywords: Italian area ; Geodynamics ; Static gravity field ; Deformations ; Dynamic gravity field
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 5
    Publication Date: 2021-02-03
    Description: Ocean acidification is one of the most dramatic effects of the massive atmospheric release of anthropogenic carbon dioxide (CO2) that has occurred since the Industrial Revolution, although its effects on marine ecosystems are not well understood. Submarine volcanic hydrothermal fields have geochemical conditions that provide opportunities to characterise the effects of elevated levels of seawater CO2 on marine life in the field. Here, we review the geochemical aspects of shallow marine CO2-rich seeps worldwide, focusing on both gas composition and water chemistry. We then describe the geochemical effects of volcanic CO2 seepage on the overlying seawater column. We also present new geochemical data and the first synthesis of marine biological community changes from one of the best-studied marine CO2 seep sites in the world (off Vulcano Island, Sicily). In areas of intense bubbling, extremely high levels of pCO2 ([10,000 latm) result in low seawater pH (\6) and undersaturation of aragonite and calcite in an area devoid of calcified organisms such as shelled molluscs and hard corals. Around 100–400 m away from the Vulcano seeps the geochemistry of the seawater becomes analogous to future ocean acidification conditions with dissolved carbon dioxide levels falling from 900 to 420 latm as seawater pH rises from 7.6 to 8.0. Calcified species such as coralline algae and sea urchins fare increasingly well as sessile communities shift from domination by a few resilient species (such as uncalcified algae and polychaetes) to a diverse and complex community (including abundant calcified algae and sea urchins) as the seawater returns to ambient levels of CO2. Laboratory advances in our understanding of species sensitivity to high CO2 and low pH seawater, reveal how marine organisms react to simulated ocean acidification conditions (e.g., using energetic tradeoffs for calcification, reproduction, growth and survival). Research at volcanic marine seeps, such as those off Vulcano, highlight consistent ecosystem responses to rising levels of seawater CO2, with the simplification of food webs, losses in functional diversity and reduced provisioning of goods and services for humans.
    Description: Published
    Description: 93–115
    Description: 2IT. Laboratori analitici e sperimentali
    Description: JCR Journal
    Keywords: Calcifying species , Ecosystem effects, Natural analogues, Submarine hydrothermalism ; 03. Hydrosphere ; 03.04. Chemical and biological ; 03.02. Hydrology ; 04.08. Volcanology
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 6
    Publication Date: 2021-02-23
    Description: The investigation of soil response to dynamic loads is necessary to predict site-specific seismic hazard. This paper presents the results of cyclic and dynamic laboratory tests carried out after the 2016–2017 Central Italy Earthquake sequence, within the framework of the seismic microzonation studies of the most damaged municipalities in the area. The database consists of 79 samples investigated by means of dynamic resonant column tests, cyclic torsional shear tests or cyclic direct simple shear tests. Results are firstly analysed in terms of field and laboratory values of small-strain shear wave velocity, highlighting the influence of the sample disturbance and of the mean effective consolidation pressure. The cyclic threshold shear strains as a function of plasticity index are then compared with findings from the published literature and the outliers are analysed. Subsequently, the dynamic soil behaviour is investigated with reference to the small-strain damping ratio. Differences between results from different tests are analysed in the light of the loading frequencies. Finally, the database is used to develop a predictive model for soil nonlinear curves according to plasticity index, mean effective confining stress, and loading frequency. The model represents a useful tool to predict the nonlinear stress–strain behaviour of Central Italy soils, necessary to perform site-specific ground response analyses.
    Description: Published
    Description: 5503–5531
    Description: 5T. Sismologia, geofisica e geologia per l'ingegneria sismica
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 7
    Publication Date: 2021-02-23
    Description: No abstract
    Description: Published
    Description: 5415–5422
    Description: 5T. Sismologia, geofisica e geologia per l'ingegneria sismica
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 8
    Publication Date: 2021-03-03
    Description: Since 1938, Nyamulagira volcano (Democratic Republic of Congo) has operated as a classic pressurized basaltic closed system, characterized by frequent dike-fed flank eruptions. However, on June 24, 2014, an active lava lake was observed in its summit, after a period of 76 years. The small lava lake is now exposed at the bottom of a pit-crater and is rising and growing. Based on satellite-derived infrared (IR) data, SO2 fluxes and periodic field surveys, we provide evidence that the development of the lava lake was gradual and occurred more than 2 years before it was first observed in the field. Notably, this process followed the voluminous 2011–2012 distal flank eruption and was coeval with weakening of the central rock column below the summit. Hence, the opening and development of the pit-crater favoured the continuous rise of fresh magma through the central conduit and promoted the gradual “re-birth” of the Nyamulagira lava lake. Budgeted volumes of magma erupted, and magma degassed at depth indicate that the formation of the lava lake is due to the draining and refilling of a shallow plumbing system (1–2 km depth), probably in response to the rift-parallel 2011–2012 distal eruption. We thus suggest that the transition from lateral to central activity did not result from a substantial change in the magma supply rate but, more likely, from the perturbation of the plumbing system (and related stress field) associated with the distal eruption. The processes observed at Nyamulagira are not unique and suggest that rift-fissure eruptions, in addition to triggering caldera collapses or lava lake drainages, may also induce a progressive resumption of central vent activity. Current activity at Nyamulagira represents a tangible and major hazard for the population living at the base of its southern flank.
    Description: Published
    Description: 20
    Description: 5V. Processi eruttivi e post-eruttivi
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 9
    Publication Date: 2021-03-03
    Description: In the last years, because of uncontrolled human activities, a significant increase of groundwater pollution occurred worldwide, with nitrate being among the most widespread pollutants. The assessment of groundwater vulnerability represents an important tool for developing groundwater quality plans and in the delimitation of “Nitrate Vulnerable Zones”. In this study, three rating methods (DRASTIC, SINTACS and GOD) were applied in an alluvial plain to check the reliability of the results comparing the obtained thematic maps with the observed nitrate concentrations in groundwater. Results show that without large modifications for specific vulnerability, these methodologies cannot describe the actual groundwater nitrate distribution in the study area. A new easy methodology called Protection from Natural and Anthropogenic sources (PNA) was then defined and tested. The PNA map divides the study area in five classes of vulnerability from very low to very high and shows a fair correlation with groundwater nitrate concentrations. The selection of the parameters and of the algorithm makes PNA strongly flexible and applicable in similar watersheds around the world, as a tool for the delineation of “Nitrate Vulnerable Zones”.
    Description: Published
    Description: 104
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 10
    Publication Date: 2021-05-12
    Description: .The estimation of CO2 storage capacity in deep geologic formations is a pre-requisite for an efficient and safe application of Carbon Capture and Storage (CCS). The evaluation of storage resources for CO2 geological sequestration is a challenging task and has been tackled using several static algorithms and dynamic methods, on a variety of scales ranging from country to site-specific. The purpose of this study is to present an up-to-date as well as an overall review of the storage capacity algorithms for oil and gas reservoirs, coal seams, and deep saline aquifers, including some worldwide estimation examples. Moreover, a practical application at local scale was also performed for an Italian deep reservoir located in the Po Plain (Northern Italy). The effective storage capacities were obtained applying the commonly established static methods, using both the theoretical and the geocellular volume of the reservoir. Although a conservative approach, this study demonstrates that the selected structure has favorable characteristics for CO2 geological storage and has the capacity to host the most part of the Po Plain CO2 emissions for several decades.
    Description: Published
    Description: 21-44
    Description: 1TR. Georisorse
    Keywords: Saline Aquifer Capacity Estimation Deep Saline Aquifer Effective Storage Capacity
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: book chapter
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  • 11
    Publication Date: 2021-05-12
    Description: The long-term warming of the ocean is a critical indicator of both the past and present state of the climate system. It also provides insights about the changes to come, owing to the persistence of both decadal variations and secular trends, which the ocean records extremely well (Hansen et al., 2011; IPCC, 2013; Rhein et al., 2013; Trenberth et al., 2016; Abram et al., 2019). It is well established that the emission of greenhouse gasses by human activities is mainly responsible for global warming since the industrial revolution (IPCC, 2013; Abram et al., 2019). The increased concentration of heat-trapping greenhouse gases in the atmosphere has interfered with natural energy flows. Currently there is an energy imbalance in the Earth’s climate system of almost 1 W m−2 (Trenberth et al., 2014; von Schuckmann et al., 2016, 2020a; Wijffels et al., 2016; Johnson et al., 2018; Cheng et al., 2019a; von Schuckmann et al., 2020a). Over 90% of this excess heat is absorbed by the oceans, leading to an increase of ocean heat content (OHC) and sea level rise, mainly through thermal expansion and melting of ice over land. These processes provide a useful means to quantify climate change. The first global OHC time series by Levitus et al. (2000) identified a robust long-term 0−3000 m ocean warming from 1948−98. Since then, many other analyses of global and regional OHC data have been performed. Here, we provide the first analysis of recent ocean heating, incorporating 2020 measurements through 2020 into our analysis.
    Description: Published
    Description: 523–530
    Description: 4A. Oceanografia e clima
    Description: JCR Journal
    Keywords: ocean temperature ; climate change ; climate change
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 12
    Publication Date: 2021-01-04
    Description: We present a methodology for the selection of accelerometric time histories as input for dynamic response analyses over vast areas. The method is primarily intended for seismic microzonation studies and regional probabilistic seismic hazard assessments that account for site effects. It is also suitable for structural response analyses if one would like to use a fixed set of ground motion records for analyzing multiple structures with different (or unknown) periods. The proposed procedure takes advantage of unsupervised machine learning techniques to identify zones (i.e., groups of sites) with homogeneous seismic hazard, for which the same set of earthquake recordings can be reasonably used in the numerical simulations. The procedure consists of three steps: (1) data-driven cluster analysis to identify groups of sites with comparable seismic hazard levels for a specified mean return period (MRP); (2) for each zone, definition of a single, reference uniform hazard spectrum (UHS) corresponding to the MRP of interest; (3) selection of a set of accelerometric recordings that are consistent with the magnitude-distance scenarios contributing to the hazard of each zone, and meet the spectrum-compatibility requirement with respect to the reference UHS. An application of the procedure in the Po Plain (Northern Italy) is described in detail.
    Description: Published
    Description: 2985–3004
    Description: 5T. Sismologia, geofisica e geologia per l'ingegneria sismica
    Description: JCR Journal
    Keywords: Probabilistic seismic hazard ; Seismic hazard disaggregation ; Seismogram selection ; Cluster analysis
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 13
    Publication Date: 2021-01-25
    Description: The Onano eruption (~ 0.17 Ma) is the second to last caldera-forming eruption of the Latera volcano, in the northernmost sector of the Roman Comagmatic Province (Latium, Italy). The stratigraphic sequence, from base to top, includes ash and pumice-rich flow deposits, spatter-rich flow deposits and lag breccias associated with ash-rich flow deposits. By combin-ing major and trace element compositions of the bulk rocks, matrix glasses and minerals of juvenile components from the different depositional units, we reconstruct the pre-eruptive evolution of the magma chamber and the syn-eruptive magma dynamics. Juvenile clasts with heterogeneous glass composition and/or mineral assemblage are a ubiquitous feature of the Onano eruption. The products cover a large compositional range from phonotephrite to phonolite. They are crystal poor, with felsic paragenesis associated to Mg-rich olivine (Fo82–90) and diopside (Fs4–7), these last not in equilibrium with the erupted melts. The mafic mineral assemblage suggests that the pre-eruption magma reservoir was periodically perturbed by the arrival of a primitive magma carrying on Mg-rich minerals and/or remobilizing a mafic crystal mush at the bottom of the reservoir. According to the results obtained from both rhyolite-MELTS and Rayleigh crystal fractionation modeling, we infer that the system evolved from phonotephrite to phonolite both via crystal fractionation and magma mixing between the two end members. Crystallization mostly proceeded at the wall of the reservoir, while magma mixing in the middle zones of the chamber generated the intermediate tephriphonolitic melts. The pre-eruptive chemical zoning was disrupted during the course of the eruption due to the simultaneous withdrawal of magma from different portions of the reservoir. During the first phase of the eruption, high-silica tephriphonolitic to phonolitic melts, residing in the upper part of the reservoir, were emitted with less involvement of the deeper phonotephrite. Phonotephritic magmas, with only a minor contribution of evolved melts, were later erupted as spatter-rich pyroclastic flows that preceded the main caldera collapse. During the caldera collapse, the whole reservoir was involved, leading to extensive and intimate syn-eruption mingling of the different melts. A comparison between the Onano eruption and other eruptions of the Italian high potassic volcanism provides new insights into the evolution of the Roman Comagmatic Province magmas and their eruptive processes.
    Description: FISR 2016, Project “Centro di studio e monitoraggio dei rischi naturali dell’Italia Centrale.
    Description: Published
    Description: 84
    Description: 4V. Processi pre-eruttivi
    Description: JCR Journal
    Keywords: Latera volcano ; Mafic caldera-forming eruption ; Mineral chemistry ; Magma mixing/mingling ; The Onano eruption (Latera volcano, Central Italy) ; magma mixing/mingling ; caldera‑forming eruption
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 14
    Publication Date: 2021-02-23
    Description: The Pietra del Pertusillo freshwater reservoir is a major artificial lake of environmental, biological, and ecological importance located in the Basilicata region, southern Italy. The reservoir arch-gravity dam was completed in 1963 for producing hydroelectric energy and providing water for human use, and nearby there are potential sources of anthropogenic pollution such as urban and industrial activities. For the first time, the minero-chemistry of the lake and fluvio-lacustrine sediments of the reservoir have been evaluated to assess the environmental quality. Moreover, the composition of fluvial sediments derived from the peri-lacual zone of the reservoir and of local outcropping bedrock were also studied to understand the factors affecting the behavior of elements in the freshwater reservoir, with particular attention paid to heavy metals. In Italy, specific regulatory values concerning the element threshold concentration for lake and river sediments do not exist, and for this reason, soil threshold values are considered the standard for sediments of internal waters. The evaluation of the environmental quality of reservoir sediments has been performed using enrichment factors obtained with respect to the average composition of a reconstructed local upper continental crust. We suggest this method as an innovative standard in similar conditions worldwide. In the studied reservoir sediments, the trace elements that may be of some environmental concern are Cr, Cu, Zn, As, and Pb although, at this stage, the distribution of these elements appears to be mostly driven by geogenic processes. However, within the frame of the assessment and the preservation of the quality of aquatic environments, particular attention has to be paid to As (which shows median value of 10 ppm, reaching a maximum value of 26 ppm in Quaternary sediments), constantly enriched in the lacustrine samples and especially in the fine-grained fraction (median = 8.5 ppm).
    Description: Published
    Description: 4857–4878
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
    Keywords: Enrichment factors; Environmental quality; Heavy metals; Lake sediments; Mineralogy; Risk assessment
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 15
    Publication Date: 2021-02-23
    Description: The explosive eruptions that occurred between nineteenth and twentieth centuries produced a fundamental cultural impact on the development of Volcanology. Pyroclastic products and ignimbrites features start to be at the base of an international debate. Various descriptions of explosive eruptions, and a new terminology of their products, such as nuée ardente and ignimbrite, were presented and extensively discussed in the framework of the International Association of Volcanology conferences held in 1961 at Catania and in 1963 at Tokyo. Ignimbrite deposits are frst assimilated to welded tufs. That attention to explosive volcanism of the frst half of the twentieth century was the context in which has matured the Alfred Rittmann model of rheoignimbrite as welded ignimbrite showing secondary fowage structures. This term introduced by Rittmann in 1958, and shared by Giorgio Marinelli in 1961, was intended to describe the extensive sheet of acidic vitrophyric volcanic rocks of Monte Amiata volcano, interpreted as lava fows by all previous authors. Rheomorphic ignimbrites, in the Rittmann model, have features that strongly diferentiate them from normal ignimbrites and that are very similar to what shown by acidic lava fows, as fuidal structures and wrinkles. The concept of rheomorphic ignimbrite is still in use into the volcanological literature, even if not for the Monte Amiata volcanics, nowadays defnitively considered to be lava fows and domes. However, the Rittmann and Marinelli authoritative assumptions inhibited, up to present times, new volcanological interpretation of Monte Amiata acidic lavas.
    Description: Published
    Description: 539–561
    Description: 1V. Storia eruttiva
    Description: 3V. Proprietà chimico-fisiche dei magmi e dei prodotti vulcanici
    Description: 6SR VULCANI – Servizi e ricerca per la società
    Description: JCR Journal
    Keywords: Ignimbrite ; Rheoignimbrite ; Monte amiata ; Acidic lava fow ; Alfred Rittmann ; Giorgio Marinelli
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 16
    Publication Date: 2021-03-03
    Description: Deterioration of groundwater quality due to the introduction of pollutants from natural and anthropic sources has become a major environmental issue. We tested three methodologies in assessing groundwater quality and intrinsic aquifer vulnerability in the Agro-Aversano area (Southern Italy). A geographic information system (GIS)-based groundwater quality index (GQI) was realized to assess groundwater quality for drinking and irrigation use and, in parallel, standard SINTACS was applied to evaluate the intrinsic vulnerability of the aquifer. Nitrate concentrations and sodium absorption ratio (SAR) in groundwater samples were used to verify the reliability of vulnerability data. GQI analysis pointed to a general poor quality of groundwater both for drinking and irrigation use, especially in sub-urban areas. The spatial pattern of water quality from GQI analysis was positively related to nitrate and fluoride concentrations for drinking use and to bicarbonate and sodium concentrations for irrigation use, whose levels exceeded the WHO and FAO recommended thresholds, respectively. Standard SINTACS was found to be inadequate for describing the aquifer state, its results showing no correlation with nitrate concentration or SAR. Because of this inconsistency, we tested a novel approach combining GQI with SINTACS analysis. Results showed positive correlation with nitrate (r = 0.63) and SAR (r = 0.64) contents, thus pointing to combined SINTACS-GQI as a more reliable approach than standard methodologies.
    Description: Published
    Description: 768
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
    Keywords: Alluvial aquifer; Groundwater quality index; Nitrate pollution; Vulnerability assessment
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 17
    Publication Date: 2021-05-12
    Description: Viruses of hyperthermophilic archaea represent one of the least understood parts of the virosphere, showing little genomic and morphological similarity to viruses of bacteria or eukaryotes. Here, we investigated virus diversity in the active sulfurous fields of the Campi Flegrei volcano in Pozzuoli, Italy. Virus-like particles displaying eight different morphotypes, including lemon-shaped, droplet-shaped and bottle-shaped virions, were observed and five new archaeal viruses proposed to belong to families Rudiviridae, Globuloviridae and Tristromaviridae were isolated and characterized. Two of these viruses infect neutrophilic hyperthermophiles of the genus Pyrobaculum, whereas the remaining three have rod-shaped virions typical of the family Rudiviridae and infect acidophilic hyperthermophiles belonging to three different genera of the order Sulfolobales, namely, Saccharolobus, Acidianus, and Metallosphaera. Notably, Metallosphaera rod-shaped virus 1 is the first rudivirus isolated on Metallosphaera species. Phylogenomic analysis of the newly isolated and previously sequenced rudiviruses revealed a clear biogeographic pattern, with all Italian rudiviruses forming a monophyletic clade, suggesting geographical structuring of virus communities in extreme geothermal environments. Analysis of the CRISPR spacers suggests that isolated rudiviruses have experienced recent host switching across the genus boundary, potentially to escape the targeting by CRISPR-Cas immunity systems. Finally, we propose a revised classification of the Rudiviridae family, with the establishment of six new genera. Collectively, our results further show that high-temperature continental hydrothermal systems harbor a highly diverse virome and shed light on the evolution of archaeal viruses.
    Description: Published
    Description: 1821–1833
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: 1TR. Georisorse
    Description: JCR Journal
    Keywords: Extreme environments ; volcanic hydrothermal system ; virus ; extremophiles ; Extreme environments in volcanic hydrothermal system
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 18
    Publication Date: 2021-05-12
    Description: The occurrence of high volumes of methane during tunneling operations is a critical safety factor that can influence the choice of different technical approaches for tunnel design and construction. Moreover, gas accumulation can be influenced by fluid migration along spatially focused preferential pathways (i.e. points along faults and fracture zones) that can result in highly variable gas concentrations along the tunnel trace. This paper proposes a methodological approach to minimize the risks, and costs, related to tunnel construction in rocks with potentially high methane concentrations. This approach combines soil gas geochemistry and structural geology surveys along and across the main faults and fracture systems that occur in the study area. The procedure is based on near-surface sampling and consists of a two-pronged approach: the measurement of fault zone gas emissions and their classification as barrier or conduit zones. Moreover, it is illustrated the importance of measuring a wide spectrum of different gas species, not just methane, for a more accurate interpretation of the geological, geochemical, and structural systems. This is due to the potential for multiple gas origins, different gas associations, and various alteration and oxidation processes (e.g., CH4 oxidation into CO2) that can modify the geochemical signal along the flow path as gas migrates towards the surface.
    Description: Published
    Description: 1035-1038
    Description: 9T. Geochimica dei fluidi applicata allo studio e al monitoraggio di aree sismiche
    Keywords: soil gas ; tunnel ; 04.04. Geology
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: book chapter
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  • 19
    Publication Date: 2021-05-12
    Description: The analysis of trace metals and metalloids, and the Sr-isotopic systematics were applied to 16 must samples from vines growing in the Sesia Val Grande Supervolcano UNESCO Global Geopark in the northern Piedmont Region (Italy), a land worldwide famous for the production of quality Nebbiolo-based red wines. Twenty-four elements were measured in each sample with inductively coupled plasma-mass spectrometry (ICP-MS). The results indicate a wide variability in trace element concentration in musts from the different vineyards. In particular, Rb and Sr reach their maximum at 5110 and 694 µg L−1, respectively, reflecting the geological nature of the magmatic bedrocks. Fe, Cu, Pb and Ba concentrations reach 3118, 1200, 130 and 720 µg L−1, respectively, suggesting a source from iron oxide, Pb–Zn and Ba ores associated to the volcanic activity. The 87Sr/86Sr ratio is in the range 0.711608–0.718160, showing a highly radiogenic signature which is uncommon in must/wine. This is consistent with the high 87Sr/86Sr isotopic ratio of the old rhyolitic bedrocks. Furthermore, the 87Sr/86Sr ratio in musts linearly correlates with the corresponding 87Rb/86Sr ratio, reflecting the Rb and 87Sr release from primary minerals during pedogenesis and matching the initial 87Sr/86Sr ratio of the parent bedrocks magmatic reservoir, thus assuming importance for authenticity assessment.
    Description: Published
    Description: 1027–1035
    Description: 2V. Struttura e sistema di alimentazione dei vulcani
    Description: 3V. Proprietà chimico-fisiche dei magmi e dei prodotti vulcanici
    Description: 4V. Processi pre-eruttivi
    Description: JCR Journal
    Keywords: Wine traceability ; Trace elements ; · Sr-isotopes ; Nebbiolo wine ·
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 20
    Publication Date: 2021-05-12
    Description: The focus of this study is Anthemountas basin in northern Greece, where land subsidence phenomena had been previously identified. The basin has a NNW-SSE orientation, which is optimal to the currently acting ~ N-S extension field in the back-arc Aegean area and is bordered to its north and south edge by two, well-pronounced faults. The region of study is located close to the greater metropolitan city of Thessaloniki and comprises a number of critical facilities including the city’s international airport. The research object is the monitoring of the evolution of the displacement at Anthemountas graben, using InSAR time-series and the investigation of the dominant driving mechanism. We show new surface displacement results from the ENVISAR satellite, and overall, an enhanced dataset of SAR time-series is presented, spanning the period 1992 to 2010, by using the satellites ERS1, ERS2 and ENVISAT. Results indicate a continuously deforming environment in both decades, with an increasing magnitude. The detailed study of the deformation pattern together with the analysis of in situ data defines aquifer overpumping as the main cause of the detected displacement of both decades. Critical regions are examined in detail, as for example: an area close to Thermi, the town of Perea and the Thessaloniki’s international airport, a major hub of the Balkans. The latter was subjected to an increasing deforming velocity during the monitoring period. Overall, we conclude that a water management plan should be of high priority for the area.
    Description: Published
    Description: 518
    Description: 2T. Deformazione crostale attiva
    Description: JCR Journal
    Keywords: Aquifer activity ; InSAR time-series ; 04.03. Geodesy ; 04.04. Geology
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 21
    Publication Date: 2021-01-07
    Description: The geological and geophysical data acquired during cruise 45 of R/V Akademik Nikolaj Strakhov regarding the structure of the Doldrums megatransform system in the Central Atlantic are presented. Taking into account the data of the previous expeditions, the structure of this region is examined in detail. The bathymetric data confirm the complex morphology, consisting of five dextral transform faults, separated by four active intra-transform rift segments and indicates the variability of tectonic conditions in this region. The dredged rocks are represented by the entire spectrum from the mantle to the upper crustal varieties and, together with the detailed topographic data, make it possible to identify the origin of the key structures in the Doldrums megatransform system.
    Description: Published
    Description: 131–134
    Description: 3A. Geofisica marina e osservazioni multiparametriche a fondo mare
    Description: 2TR. Ricostruzione e modellazione della struttura crostale
    Description: JCR Journal
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  • 22
    Publication Date: 2021-01-07
    Description: Herein we provide information on the integrated geological, geophysical, sedimentological, paleoceanographic, hydrophysical and biological investigations in the Central Atlantic during the cruise 45 of the R/V “Akademik Nikolaj Strakhov” in October-November 2019. The preliminary scientific results are discussed.
    Description: Published
    Description: 424–426
    Description: 3A. Geofisica marina e osservazioni multiparametriche a fondo mare
    Description: JCR Journal
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  • 23
    Publication Date: 2021-01-11
    Description: The parametric catalogue of Italian earthquakes CPTI15 (Catalogo Parametrico dei Terremoti Italiani) represents the latest of a 45-years-long tradition of earthquake catalogues for Italy, and a significant innovation with respect to its predecessors. CPTI15 combines all known information on significant Italian earthquakes of the period 1000–2017, balancing instrumental and macroseismic data. Although the compilation criteria are the same as in the previous CPTI11 version, released in 2012, the catalogue has been revised as concerns: the time coverage, extended to 2017; the associated macroseismic data, improved in quantity and quality; the considered instrumental data, new and/or updated; the energy thresholds, lowered to maximum or epicentral intensity 5 or magnitude 4.0 (instead of 5–6 and 4.5, respectively); the determination of parameters from macroseismic data, based on a new calibration; the instrumental magnitudes, resulting from new sets of data and new conversion relationships to Mw. The catalogue considers and harmonizes data of different types and origins, both macroseismic and instrumental. For all earthquakes, the magnitude is given in terms of true or proxy moment magnitude (Mw), with the related uncertainty. The compilation procedure rigorously implements data and methods published in peerreviewed journals. All data and methods are clearly indicated in the catalogue, in order to guarantee the maximum transparency of the compilation procedures. As compared to previous CPTI releases, the final CPTI15 catalogue shows a frequency–magnitude distribution coherent with current Italian instrumental catalogues, making it suitable for statistical analysis of the time-space property of the Italian seismicity.
    Description: Published
    Description: 2953–2984
    Description: 4T. Sismicità dell'Italia
    Description: 6T. Studi di pericolosità sismica e da maremoto
    Description: JCR Journal
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  • 24
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    Springer
    Publication Date: 2021-01-05
    Description: This work shows the results achieved using two prototypes of monitoring and processing systems that are being developed with the aim of increasing the safety and the security in harbours. The first one has been designed to help port communities (port authorities, pilots) to manage harbour waterside (optimization of ship’s navigation and cargo, dock performances, boat moorings, refloating of stranded ships, water quality control). Starting from monitoring the sea level and meteorological parameters in harbours, it can help port communities decide, e.g., when a ship with a certain draft can enter or leave the port, or which the best route to follow is (port safety). The second system, instead, deals with the monitoring of the Earth’s magnetic field in port areas for harbour protection purposes, in particular to detect the possible presence of underwater intruders, e.g. divers swimming in restricted areas (port security). The processing procedures of both systems are based not on commercial software, but on applications under development by the research team the author belongs to, by using C# and C++ languages and Matlab environment.
    Description: Published
    Description: 91-102
    Description: 3A. Geofisica marina e osservazioni multiparametriche a fondo mare
    Description: 4A. Oceanografia e clima
    Keywords: Port navigation safety ; Harbour protection ; Underwater detection systems
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: book chapter
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  • 25
    Publication Date: 2021-01-05
    Description: A large amount of data about earthquake effects, supplied by citizens through a web-based questionnaire, enabled the analysis of the occurrence of many of the effects on humans and objects listed in macroseismic scales descriptions. Regarding the other diagnostic effects (rattling, moving, shifting, falling or overturning depending of the object type of doors, windows, china, glasses, small objects, pictures, vases, books, as well as frightened peo- ple and animal behaviour), data from more than 300,000 questionnaires about earthquakes felt in Italy from June 2007 to August 2017, were analysed by stacking them together as a function of hypocentral distance and magnitude. The comparison of the resulting percent- ages with the intensity prediction equation showed that almost all the chosen effects are good diagnostics for macroseismic intensity evaluation, as their percentages are well dif- ferentiated. We did not analyse the oscillations of hanging objects and liquids because the differences in effect attenuations, highlighted by the maps of the occurrence percentage, suggested to not consider them as diagnostic effect. This result allowed us to quantify the occurrence of each diagnostic effect for the intensity degrees from II to VI of the European macroseismic scale for the people who felt the earthquake. The application of the intensity assessment method to internet macroseismic data, based on the specifications herein pro- posed, should mitigate the problem of “not felt” undersampling in crowdsourced web data.
    Description: Published
    Description: 1957–1973
    Description: 4T. Sismicità dell'Italia
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 26
    Publication Date: 2021-01-05
    Description: In the last few decades, the use of GNSS Continuously Operating Reference Station (CORS) networks allowed improving the accuracy of realtime positioning and post-processing positioning. In this way, several applications have been performed including remote sensing, agriculture, cultural heritage and geodynamics studies. The latter have been developed analysing CORS time-series and consistent data over long periods were needed to validate the results. In Italy, specifically in Sicily, two CORS networks were be used to monitor the geodynamics motions: the Istituto Nazionale di Geofisica e Vulcanologia (INGV) GNSS CORS network in the eastern part and the University of Palermo (UNIPA) GNSS CORS network in the western part. In this research, preliminary results of time series about geodynamics motions of the western part of Sicily have been presented. In particular, the time series of the UNIPA GNSS CORS network have been analyzed over time by using the static positioning, over a period of approximately 5 years. Results showed a linear trend for all CORS time series, according to literature. An innovative methodology, the static Precise Point Positioning (PPP) has been also tested, to determine the time series of one CORS and compare the results with the static solution. The comparison between the two methodologies (static and PPP) demonstrated the capabilities of PPP technique with benefits in terms of costs and time.
    Description: Published
    Description: 61-76
    Description: 2T. Deformazione crostale attiva
    Keywords: GNSS time series analysis ; 04.03. Geodesy
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: book chapter
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  • 27
    Publication Date: 2021-01-22
    Description: Numerical models of pyroclastic currents are widely used for fundamental research and for hazard and risk modeling that supports decision-making and crisis management. Because of their potential high impact, the credibility and adequacy of models and simulations needs to be assessed by means of an established, consensual validation process. To define a general validation framework for pyroclastic current models, we propose to follow a similar terminology and the same methodology that was put forward by Oberkampf and Trucano (Prog Aerosp Sci, 38, 2002) for the validation of computational fluid dynamics (CFD) codes designed to simulate complex engineering systems. In this framework, the term validation is distinguished from verification (i.e., the assessment of numerical solution quality), and it is used to indicate a continuous process, in which the credibility of a model with respect to its intended use(s) is progressively improved by comparisons with a suite of ad hoc experiments. The method- ology is based on a hierarchical process of comparing computational solutions with experimental datasets at different levels of complexity, from unit problems (well-known, simple CFD problems), through benchmark cases (complex setups having well constrained initial and boundary conditions) and subsystems (decoupled processes at the full scale), up to the fully coupled natural system. Among validation tests, we also further distinguish between confirmation (comparison of model results with a single, well-constrained dataset) and benchmarking (inter-comparison among different models of complex experimental cases). The latter is of particular interest in volcanology, where different modeling approaches and approximations can be adopted to deal with the large epistemic uncertainty of the natural system.
    Description: Published
    Description: 51
    Description: 5V. Processi eruttivi e post-eruttivi
    Description: 6V. Pericolosità vulcanica e contributi alla stima del rischio
    Description: JCR Journal
    Keywords: pyroclastic currents, benchmark, validation ; 04.08. Volcanology
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 28
    Publication Date: 2021-02-23
    Description: This paper deals with the online offset detection in GPS time series recorded in volcanic areas. The interest for this problem lies in the fact that an offset can indicate the opening of eruptive fissures. A Change Point Detection algorithm is applied to carry out, in an online framework, the offset detection. Experimental results show that the algorithm is able to recognize the offset generated by the Mount Etna eruption, occurred on December 24, 2018, with a delay of about 4 samples, corresponding to 40 min, compared to the best offline detection. Furthermore, analysis of the trade-off between success and false alarms is carried out and discussed.
    Description: Published
    Description: 267–276
    Description: 2T. Deformazione crostale attiva
    Description: JCR Journal
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  • 29
    Publication Date: 2021-02-22
    Description: To understand the behavior of gas escaping a rapidly decompressed particle bed, an experimental study is performed in a cylindrical (D = 41 mm) glass vertical shock tube containing a densely packed particle bed. The bed is comprised of spherical glass beads. Two sets of beads are used, with median diameters of 67.5 and 254.5 m. The volume fraction of the glass beads is approximately 60%. High-speed pressure sensors capture the shock wave and expansion wave fronts. Optical measurements based on particle image velocimetry (PIV) are developed to examine the velocity of gas initially above the bed as well as gas initially within the interstices of the particle bed using both quantitative and qualitative visualization techniques. For above-bed gas flow analysis, passive tracer particles are seeded above the bed, whereas for interstitial gas measurements, lightweight but non-passive particles are mixed into the upper layers of the bed itself. Development of this technique to optically measure interstitial escape flow is utilized herein to measure the gas rise velocity in response to variation in bead diameter, with faster gas velocities observed as bead diameter increases. For the experiments performed herein, an initial acceleration of the gas velocity is observed at the earliest stages of particle bed decompression, whereas the gas velocity begins to decelerate between 1.25 and 2.25 ms of the estimated arrival of the expansion wave at the particle bed.
    Description: Published
    Description: 236
    Description: 5V. Processi eruttivi e post-eruttivi
    Description: JCR Journal
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  • 30
    Publication Date: 2021-03-03
    Description: Groundwater from the Mondragone Plain (Southern Italy) has been investigated by a monthly sampling regimen over the course of a hydrologic year in order to analyze geochemical signatures and has been experienced methods for detecting natural and anthropogenic contamination dynamics that affect resources for human water supply. The Mondragone Plain aquifer is characterized by (1) anthropogenic land uses, (2) varying degrees of hydrothermal interactions, and (3) the potential for seawater intrusion. Anomalies induced by anthropogenic pollution produce non-normally distributed time series and an alteration of the natural SO4 2− background of groundwater. Variables depending on natural processes are related to water–rock interactions along groundwater flow path, i.e., the hosting aquifer lithology of hydrothermal systems, the recharging massifs of Mt. Petrino and Mt. Massico, and more recent volcanic and alluvial formations. Solute transport in groundwater affects the urban aquifer, both by mixing of thermal waters and by ions deriving from agricultural activity (NO3 −, SO4 2−, NH4 +), compromising the quality of a resource largely used by locals. The two thermal systems in the studied area [Levagnole and Padule–San Rocco] are two different aquifers with an independent circulation and chemical composition. Seawater intrusion, both into thermal systems and into shallow aquifers, seems to be unlikely despite the detected increase of salinity in the LEV system close to the shoreline.
    Description: Published
    Description: 7115–7134
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 31
    Publication Date: 2021-03-03
    Description: The dynamics of natural contamination by Al and Fe colloids in volcanic aquifers of central-southern Italy were investigated. Localized perched aquifers, and their relative discharges, are strongly affected by the presence of massive suspended solids, which confer a white-lacteous coloration to the water. This phenomenon occasionally caused the interruption of water distribution due to the exceeding of Al and Fe concentrations in aquifers exploited for human supply. The cause was ascribed to water seepage from perched aquifers. Water discharges affected by such contamination was investigated for the Rocca Ripesena area (north-eastern sector of Vulsini Volcanic District) and for the Rianale Stream Valley (Roccamonfina Volcanic Complex). Hydrogeological survey of both areas confirmed the presence of perched aquifers not previously considered due to their low productivity. Pluviometric data and chemical parameters were periodically monitored. Water mineralization decreased with increasing rainfall, conversely Al and Fe concentrations increased. Statistical analysis confirmed the dependence of all the chemical variables on rock leaching, with the sole exception of Al and Fe which were imputed to colloids mobilization from local, strongly pedogenized pyroclastic material. The similarities in hydrogeological settings and mobilization dynamics in both areas suggest that the Al and Fe colloidal contamination should be more abundant than currently known in quaternary volcanic areas.
    Description: Published
    Description: 19958–19977
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
    Keywords: Al and Fe natural contamination; Groundwater; Hydrogeological conceptual models; Mineral colloids; Perityrrhenic quaternary volcanoes; Volcanic aquifers
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 32
    Publication Date: 2021-03-03
    Description: The geochemistry of natural thermal fluids discharging in the Mondragone Plain has been investigated. Thermal spring emergences are located along the Tyrrhenian coast in two different areas: near Padule-S. Rocco (41°7.5′N 13°53.4′E) at the foot of Mt. Petrino, and near Levagnole (41°8.5′N 13°51.3′E) at the foot of Mt. Pizzuto. The water isotopic composition of both thermal discharges is lighter than the one of local shallow groundwater (δ18O ≅ −6.3‰ SMOW vs. ≅ −5.9‰; δD ≅ −40‰ SMOW vs. ≅ −36‰, respectively) as a consequence of inland higher altitude of recharge by rainfall, suggesting that thermal water undergoes a deep and long flow-path before emerging along the coast. The chemical composition of the highest temperature samples of two areas points that fluids in the hydrothermal reservoir(s) interact with similar lithologies, since they are both hosted in the lower sedimentary carbonate formations of the Campanian–Latial Apennine succession. However, the two spring systems are different in terms of temperature and salinity (Levagnole: ≅50 °C and 8.9 g/L vs. Padule: ≅32 °C and 7.4 g/L, respectively). The higher salinity of Levagnole springs is due to a longer interaction with evaporite material embedded in Miocene sedimentary formations and to the eventual mixing, during rising, with fresh seawater close to the seashore. The chemical and isotopic composition of the free gases associated with the springs, again suggests a different source of the two hydrothermal systems. Comparing the 3He/4He measured ratios with other gas emissions located NE and SE of Mt. Massico-Roccamonfina alignment, it is evident that the Levagnole thermal springs are related to the northern Latial mantle wedge where the 3He/4He is about 0.5 R/Ra, whereas the Padule-S. Rocco springs, although being only 3.5 km south of Levagnole, are related to the Campanian mantle wedge where R/Ra is always ≥2.0. Such a difference in 3He/4He ratio in a very short distance, clearly, suggests a different source of the Padule-S.Rocco gas phase rising to the surface through the deep transpressive regional fault(s) system related to the NE–SW Ortona–Roccamonfina tectonic alignment.
    Description: Published
    Description: 2429–2444
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
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  • 33
    Publication Date: 2021-03-03
    Description: The use of indices, describing aquifer vulnerability and the risk of groundwater pollution, is a basic tool for the implementation of a sound water management plan, especially in densely populated and intensely cultivated areas. In this study, the groundwater contamination risk of the Caserta Plain (Southern Italy) was assessed through the integration of hazards defined on the basis of the different land uses, of the intrinsic vulnerability calculated by applying the SINTACS model and of the groundwater value evaluated by considering water wells density. In order to evaluate the evolution of the risk of groundwater pollution, the proposed methods were applied in the study area for both 2001 and 2009. The resulting specific vulnerability (SINTACS-L) and the risk (GRA) maps, created in a GIS environment, were validated by the comparison with the nitrate concentration distribution. The application of the proposed approach to the study area highlighted the strengths and weaknesses of each method and, at the same time, showed that their combination can provide an overall view of the threats posed to groundwater resources by the human activities affecting the territory. Considering both the benefits and the issues of the proposed approach, overall, the groundwater risk map is thought to be a robust tool to support water managers in defining future plans for water resources exploitation and land use.
    Description: Published
    Description: 222
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
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  • 34
    Publication Date: 2021-03-03
    Description: An overturn of Lake Kivu was seriously considered after the January 2002 Nyiragongo volcanic eruption, which erupted 20 × 106 m3 of lava from a NS-oriented fissure on the southern flank of the Congolese volcano. Part of this silica-undersaturated magma produced a lava flow that entered Lake Kivu down to a depth of 70–100 m. The possibility of a rollover comes from the fact that Lake Kivu is meromictic and below ≈250 m a CO2–CH4-rich gas reservoir is present. Thus, the riparian population (≈2,500,000 people) is endangered by a possible limnic eruption. During last 30 years several vertical profiles carried out by several researchers have evidenced a relatively pronounced vertical physico-chemical and isotopical variation. Nevertheless, saturation of CO2 and CH4 appears to be far from critical values, indicating that presently the hydrostatic pressure cannot presently be overcome. Recent studies have suggested an increase in dissolved gases (particular CH4) at depth and the uprising of the chemocline, a limnic eruption could possibly occur within 80–200 years from now. More studies are needed to follow up the lake evolution with time. Simulations will shed light on possible internal and external factors able to provoke the release a suffocating and, possibly, inflammable killer cloud. In this paper, we investigate using recent historical eruptive events of Nyiragongo volcano, we discuss the possibility that a limnic eruption may occur in a near future, although the stability of Lake Kivu is presently high: only exceptionally high magnitude events appear to be able to destabilize the 560 × 109 m3 water volume contained in its basin.
    Description: Published
    Description: 489-505
    Description: 6V. Pericolosità vulcanica e contributi alla stima del rischio
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: book chapter
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  • 35
    Publication Date: 2021-03-03
    Description: Soil 222Rn concentrations have been monitored during the 2009 autumn and Spring 2010 rainy periods, in an alluvial soil, resting on a pyroclastic substrate (locally reworked), in the Pietramelara Plain, in Southern Italy. The dry soil diurnal oscillations detected at the site in August 2009 have been found to be present also during the rainy periods of the year, provided, however, that soil moisture conditions are not affected by rainfall infiltration or post storm gravity-driven percolation in the soil depth interval considered. With significant rainfall, the characteristic dry soil diurnal cycle is altered. This rainfall-induced perturbation produces a spike-like signal featuring a sharp rise, with commencement of precipitation, then followed, with persistent and significant rainfall, by an equally sharp drop to very low levels. Both the sharp rise, resulting from capping, and the sharp drop (wash-out), resulting from infiltration, have been found to follow not previously reported second-order trends tied to cumulative rainfall, with very high statistical significance (r2[0.97 for the sharp rise and r2[0.95 for the sharp drop). Furthermore, the sharp drop appears to be tied to wetting front migration of 222Rn-free, or 222Rn-poor, rainwater and to commence when it reaches the soil probe depth, effectively flushing and transferring radon to lower levels of the profile, thus validating previous studies. Low rainfall events (1–2 mm), however, do not appear to alter significantly the dry soil diurnal cycle. Post rainstorm recovery of soil 222Rn concentrations, in the immediate aftermath of significant rainfall, appears to be very slow and limited. The spike-like pattern induced by rainstorm events poses significant questions as to the interpretation of soil 222Rn concentration time series data in geophysical precursor studies. Likewise the extreme variations resulting from rainfall, and likely affected by rainfall duration, intensity, frequency and spatial variability, pose significant implications in environmental monitoring studies aimed at characterizing representative soil 222Rn concentration levels for the wet season.
    Description: Published
    Description: 8177–8187
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
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  • 36
    Publication Date: 2021-03-02
    Description: This is the first hydro-geochemical investigation carried out on the Roccamonfina Volcanic Complex groundwater. The chemistry of Roccamonfina waters is defined by water–rock and water–rock–gas interactions. In fact, interactions between rocks of the first eruptive high-K formations and circulating groundwater are recognized by high K concentrations. On the other hand, inverse concentration of calcium versus alkali metals is related to two different rock interactions occurring in different areas of the volcano: (a) within the caldera where groundwater flow within latite and pyroclastic formations releasing calcium, and (b) similarly at the base of the volcano where groundwater flowing from surrounding carbonates got strongly enriched in Ca. These geochemical processes are also associated with K (SE of caldera) and Mg/Ca (in sites located at the NE base of the volcano) decrease. Completely different dynamics occurs at Riardo groundwater (SE). Here waters are the result of a mix between the Roccamonfina deep aquifer and the carbonate aquifer of the Riardo plain. Rich-CO2 emissions make these waters strongly mineralized. Minor elements show a similar geochemical behavior of major ions and are crucial defining interactions processes. The evolution of Roccamonfina groundwater is also evident along the simultaneous enrichment of Ba, Sr, and Ca. Ba increase is the result of deep local carbonate alteration enhanced by CO2 emissions and, the lower Sr/Ca ratio, from 10 to 2 (ppb/ppm), is also due to the same process. In the light of our results the Roccamonfina aquifer can be schematically divided into two main reservoirs: (a) a superficial aquifer which basically follows the volcanic structure morphology and tectonics and (b) a deeper reservoir, originating within the oldest Roccamonfina volcano ultra potassic lavas and then flowing into the carbonate aquifers of the neighboring plain. Eventually, the chemistry of the Roccamonfina aquifer does not show any specific and visible pollution, contrary to what happens in the volcano surrounding plains. In fact, only 14% of the samples we collected (206) show a NO3 content[30 mg/l. These sites are all located at the base of the volcano, near the plain.
    Description: Published
    Description: 525–538
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
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  • 37
    Publication Date: 2021-03-03
    Description: The Campanian Plain (CP) shallow aquifer (Southern Italy) represents a natural laboratory to validate geochemical methods for differentiating diffuse anthropogenic pollution from natural water-rock interaction processes. The CP is an appropriate study area because of numerous potential anthropogenic pollution vectors including agriculture, animal husbandry, septic/drainage sewage systems, and industry. In order to evaluate the potential for geochemical methods to differentiate various contamination vectors, 538 groundwater wells from the shallow aquifer in Campanian Plain (CP) were sampled. The dataset includes both major and trace elements. Natural water-rock interactions, which primarily depend on local lithology, control the majority of geochemical parameters, including most of the major and trace elements. Using prospective statistical methods in combination with the traditional geochemical techniques, we determined the chemical variables that are enriched by anthropogenic contamination (i.e. NO3, SO4 and U) by using NO3 as the diagnostic variable for detecting polluted groundwater. Synthetic agricultural fertilizers are responsible for the majority of SO4 and U pollution throughout the CP area. Both SO4 and U are present in the groundmass of synthetic fertilizers; the uranium concentration is specifically applicable as a tracer for non-point source agricultural fertilizer contamination. The recognition of non-geological (anthropogenic) inputs of these elements has to be considered in the geochemical investigations of contaminated aquifers.
    Description: Published
    Description: 46
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
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  • 38
    Publication Date: 2021-04-14
    Description: In this study Cr(tot), Cr(VI), major and trace elements were determined in groundwater of northern sector of the Pollino Massif (southern Italy). The investigated area is characterized by ophiolitic rocks consisting of metabasites, shales and calcschists and fractured serpentinites. Two main hydro-facies were observed, reflecting low temperature water-rock interaction. The Mg-HCO3 hydrofacies is due to the weathering of serpentinites, Ca-HCO3 groundwaters are linked to the interaction with calcschist and metabasites. High Cr(VI) concentrations were detected, exceeding the maximum admissible concentrations by Italian regulation, due to the release of Cr(III) from ophiolitic rocks into water and its oxidation to the hexavalent state. Remediation tests were carried out using two synthetized nanomaterials, Fe(0) and magnetite, characterized by a mean size lower than 50 nm. The experiments were conducted at fixed nanoparticles/Cr(VI) molar ratio and according to previous studies. In addition, the kinetic data were interpreted with a suitable mathematical model.
    Description: Published
    Description: 421–427
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
    Keywords: Groundwater; hexavalent chromium; Pollino massif; Remediation text; Serpentinites
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 39
    Publication Date: 2021-05-12
    Description: The formation of diamonds within eclogitic rocks has been widely linked to the fate of carbon during subduction and, therefore, referred to conditions of pressure, temperature, and oxygen fugacity (fo2). Mantle-derived eclogite xenoliths from Udachnaya kimberlite pipes represent a unique window to investigate the formation of carbon-free, graphite–diamondbearing and diamond-bearing rocks from the Siberian craton. With this aim, we exploited oxy-thermobarometers to retrieve information on the P–T–fo2 at which mantle eclogites from the Siberian craton equilibrated along with elemental carbon. The chemical analyses of coupled garnet and omphacitic clinopyroxene were integrated with data on their iron oxidation state, determined both by conventional and synchrotron 57Fe Mössbauer spectroscopy. The calculated fo2s largely vary for each suite of eclogite samples from 0.10 to − 2.43 log units (ΔFMQ) for C-free eclogites, from − 0.01 to − 2.91 (ΔFMQ) for graphite–diamond-bearing eclogites, and from − 2.08 to − 3.58 log units (ΔFMQ) for diamond-bearing eclogites. All eclogite samples mostly fall in the fo2 range typical of diamond coexisting with CO2- rich water-bearing melts and gaseous fluids, with diamondiferous eclogites being more reduced at fo2 conditions where circulating fluids can include some methane. When uncertainties on the calculated fo2 are taken into account, all samples essentially fall within the stability field of diamonds coexisting with CO2- bearing melts. Therefore, our results provide evidence of the potential role of CO2- bearing melts as growth medium on the formation of coexisting diamond and graphite in mantle eclogites during subduction of the oceanic crust.
    Description: Published
    Description: 107
    Description: 1T. Struttura della Terra
    Description: JCR Journal
    Keywords: redox, eclogite, diamond, magmas ; 04.01. Earth Interior
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 40
    Publication Date: 2021-05-12
    Description: We investigated the living (stained) and dead benthic foraminiferal assemblages collected in surface sediment samples (0–1 cm) from two different areas (JOIDES Basin and Mawson Bank) of the Ross Sea (Antarctica). Samples were collected during the BEDROSE oceanographic cruise from January to February 2017. Four living and dead benthic foraminiferal fauna assemblages have been distinguished based on cluster analysis. The differences observed in the living and dead foraminiferal content from the two investigated areas are the result of taphonomic processes induced by the different oceanographic settings and environmental conditions. In the JOIDES Basin, agglutinated taxa Rhabdamminella cylindrica, Lagenammina difflugiformis, Adercotryma glomeratum, Recurvoides contortus, Reophax subfusiformis with high percentages of Trochammina group and Reophax spiculifer associated with the calcareous species Nonionella bradii and Astrononion echolsi characterize the living assemblages. The comparison between living and dead benthic foraminifera reveals considerable similarities in terms of the presence/absence of agglutinated species and differences in relative abundance of calcareous taxa. However, the major influencing factor in foraminiferal preservation appears to be the carbonate dissolution. Results from Mawson Bank show an almost exclusive presence of calcareous taxa with high percentages of Globocassidulina group in both living and dead assemblages. The dead fauna assemblage differs from the corresponding living assemblage by being more diverse documenting high-energy current influence on marine sedimentation.
    Description: Published
    Description: 1037-1053
    Description: 5A. Ricerche polari e paleoclima
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 41
    Publication Date: 2021-06-07
    Description: The multi-risk concept refers to a complex variety of combinations of risk (i.e. various combinations of hazards and various combinations of vulnerabilities). For this reason, it requires a review of existing concepts of risk, hazard, exposure and vulnerability, within a multi-risk perspective. The main purpose of the multi-risk assessment is to harmonise the methodologies employed and the results obtained for different risk sources, taking into account possible risk interactions. Given the complexity of processes that the multi-risk problem poses, the framework presented here entails three levels of analysis: the first-level analysis, in which the evaluation of the potential physical damages is performed; the second-level analysis, in which tangible indirect losses are assessed considering the socio-economic context; and the third-level analysis, where a set of specific social context conditions is considered in an indicator-based approach. One of the most challenging elements of the multi-risk assessment is the translation of the quantitative output into useful information for decision-making under uncertainty. This is a critical step to consolidate the importance of the multi-risk analyses and to define their ultimate importance and usefulness for the resolution of critical societal problems. To illustrate the general methodology presented, an example application has been developed in Dar es Salaam (Tanzania), which is one of the case study cities in the CLUVA project.
    Description: Published
    Description: 229-258
    Description: 7SR AMBIENTE – Servizi e ricerca per la società
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: book chapter
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  • 42
    Publication Date: 2021-06-14
    Description: The genus Methylobacter is considered an important and often dominant group of aerobic methane-oxidizing bacteria in many oxic ecosystems, where members of this genus contribute to the reduction of CH4 emissions. Metagenomic studies of the upper oxic layers of geothermal soils of the Favara Grande, Pantelleria, Italy, revealed the presence of various methane-oxidizing bacteria, and resulted in a near complete metagenome assembled genome (MAG) of an aerobic methanotroph, which was classified as a Methylobacter species. In this study, the Methylobacter sp. B2 MAG was used to investigate its metabolic potential and phylogenetic affiliation. The MAG has a size of 4,086,539 bp, consists of 134 contigs and 3955 genes were found, of which 3902 were protein coding genes. All genes for CH4 oxidation to CO2 were detected, including pmoCAB encoding particulate methane monooxygenase (pMMO) and xoxF encoding a methanol dehydrogenase. No gene encoding a formaldehyde dehydrogenase was present and the formaldehyde to formate conversion follows the tetrahydromethanopterin (H4MPT) pathway. "Ca. Methylobacter favarea" B2 uses the Ribulose-Mono-Phosphate (RuMP) pathway for carbon fixation. Analysis of the MAG indicates that Na+/H+ antiporters and the urease system might be important in the maintenance of pH homeostasis of this strain to cope with acidic conditions. So far, thermoacidophilic Methylobacter species have not been isolated, however this study indicates that members of the genus Methylobacter can be found in distinct ecosystems and their presence is not restricted to freshwater or marine sediments.
    Description: Published
    Description: 313-324
    Description: 6A. Geochimica per l'ambiente e geologia medica
    Description: JCR Journal
    Keywords: Methane ; Methanotroph ; Volcanic soil ; Metabolic potential ; 05.09. Miscellaneous
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 43
    Publication Date: 2021-01-07
    Description: Some geophysical or geodynamic applications require the use of true vertical gradient of gravity (VGG). This demand may be associated with reductions of or corrections to observed gravity or its spatiotemporal changes. In the absence of in situ measured VGG values, the constant value of the theoretical (normal) free air gradient (FAG) is commonly used. We propose an alternative to this practice which may significantly reduce systematic errors associated with the use of constant FAG. The true VGG appears to be better approximated, in areas with prominent and rugged topography, such as alpine or some volcanic regions, by a value based on the modelled contribution of the topographic masses to the gradient. Such prediction can be carried out with a digital elevation model (DEM) of sufficient resolution and accuracy. Here we present the VGG field computed for Mt. Etna (Italy), one of the most active and best monitored volcanoes worldwide, to illustrate how strongly the VGG deviates spatially from constant FAG. The predicted (modelled) VGG field is verified by in situ observations. We also take a look at the sensitivity of the VGG prediction to the resolution and quality of used DEMs. We conclude with discussing the applicability of the topo-predicted VGG field in near surface structural and volcanological micro-gravimetric studies.
    Description: Published
    Description: 3315–3333
    Description: 1IT. Reti di monitoraggio e sorveglianza
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 44
    Publication Date: 2021-01-22
    Description: We have used a three-dimensional, non-equilibrium multiphase flow numerical model to simulate subplinian eruption scenarios at La Soufrière de Guadeloupe (Lesser Antilles, France). Initial and boundary conditions for computer simulations were set on the basis of independent estimates of eruption source parameters (i.e. mass eruption rate, volatile content, temperature, grain size distribution) from a field reconstruction of the 1530 CE subplinian eruption. This event is here taken as a reference scenario for hazard assessment at La Soufrière de Guadeloupe. A parametric study on eruption source parameters allowed us to quantify their influence on the simulated dynamics and, in particular, the increase of the percentage of column collapse and pyroclastic density current (PDC) intensity, at constant mass eruption rate, with variable vent diameter. Numerical results enabled us to quantify the effects of the proximal morphology on distributing the collapsing mass around the volcano and into deep and long valleys and to estimate the areas invaded by PDCs, their associated temperature and dynamic pressure. Significant impact (temperature 〉 300 °C and dynamic pressure 〉 1 kPa) in the inhabited region around the volcano is expected for fully collapsing conditions and mass eruption rates 〉 2 × 107 kg/s. We thus combine this spatial distribution of temperature and dynamic pressure with an objective consideration of model-related uncertainty to produce preliminary PDC hazard maps for the reference scenario. In such a representation, we identify three areas of varying degree of susceptibility to invasion by PDCs-very likely to be invaded (and highly impacted), susceptible to invasion (and moderately impacted), and unlikely to be invaded (or marginally impacted). The study also raises some key questions about the use of deterministic scenario simulations for hazard assessment, where probability distributions and uncertainties are difficult to estimate. Use of high-performance computing techniques will in part allow us to overcome such difficulties, but the problem remains open in a scientific context where validation of numerical models is still, necessarily, an incomplete and ongoing process. Nevertheless, our findings provide an important contribution to the quantitative assessment of volcanic hazard and risk at La Soufrière de Guadeloupe particularly in the context of the current unrest of the volcano and the need to prepare for a possible future reawakening of the volcano that could culminate in a magmatic explosive eruption.
    Description: Published
    Description: 76
    Description: 5V. Processi eruttivi e post-eruttivi
    Description: JCR Journal
    Keywords: Hazard assessment; La Soufrière de Guadeloupe; Numerical simulation; Pyroclastic density currents; Subplinian eruption ; 04.08. Volcanology ; 05.01. Computational geophysics
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 45
    Publication Date: 2021-01-29
    Description: eriods of accelerated seismicity have been observed during the preparation process of many large earthquakes. This accelerating seismicity can be detected by the Accelerated Moment Release (AMR) method and its recent Revised version (RAMR) when the two techniques are applied to earthquake catalogues. The main aim of this study is to investigate the seismicity preceding large mainshocks and possibly increase our comprehension of the underlying physics. In particular, we applied both the AMR and R-AMR to the seismicity preceding 14 large worldwide shallow earthquakes, i.e. with focal depth less than 40 km, with magnitude M[6 for Mediterranean area, and M C 6.4 in the rest of the world, occurred from 2014 to 2018. Twelve case studies were analysed in the framework of SwArm For Earthquake study project funded by ESA, comprising the period 2014–2016; two additional cases were also considered to confirm the goodness of the methodology outside the period of the project catalogues. In total, R-AMR shows better performances than AMR, in 11 cases out of 14. In particular, in four out of 14 cases (i.e. 28.6%), the R-AMR method shows that acceleration exists due to an evident clustering in time–space on the faults, thus guiding the convergence of the fit; in seven cases (i.e. 50%) the R-AMR discloses acceleration, although no clustering around the fault is present; the remaining three cases (i.e. 21.4%) show no emerging acceleration from background. Finally, when R-AMR is compared with simulations, we verify that in most of the cases the acceleration is real and not casual.
    Description: Published
    Description: 4057–4087
    Description: 7T. Variazioni delle caratteristiche crostali e precursori sismici
    Description: JCR Journal
    Keywords: earthquake ; precursory acceleration ; accelerated moment release ; time to failure ; 04.06. Seismology
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 46
    Publication Date: 2021-02-12
    Description: This report summarizes the seismicity in Switzerland and surrounding regions in the years 2017 and 2018. In 2017 and 2018, the Swiss Seismological Service detected and located 1227 and 955 earthquakes in the region under considera- tion, respectively. The strongest event in the analysed period was the ML 4.6 Urnerboden earthquake, which occurred in the border region of cantons Uri, Glarus and Schwyz on March 6, 2017. The event was the strongest earthquake within Switzerland since the ML 5.0 Vaz earthquake of 1991. Associated ground motions indicating intensity IV were reported in a radius up to about 50 km and locally approached intensity VI in the region close to the epicentre. Derived focal mechanisms and relative hypocentre relocations of the immediate aftershocks image a NNW–SSE striking sinistral strike-slip fault. Together with other past events in this region, the Urnerboden earthquake suggests the existence of a system of sub-parallel strike-slip faults, likely within in the uppermost crystalline basement of the eastern Aar Massif. A vigorous earthquake sequence occurred close to Château-d’Oex in the Préalpes-Romandes region in western Switzer- land. With a magnitude of ML 4.3, the strongest earthquake of the sequence occurred on July 1, 2017. Focal mechanism and relative relocations of fore- and aftershocks image a NNE dipping normal fault in about 4 km depth. Two similarly oriented shallow normal-fault events occurred between subalpine Molasse and Préalpes units close to Châtel-St-Denis and St. Silvester in 2017/18. Together, these events indicate a domain of NE–SW oriented extensional to transtensional deformation along the Alpine Front between Lake Geneva in the west and the Fribourg Fault in the east. The structural complexity of the Fribourg Fault is revealed by an ML 2.9 earthquake near Tafers in 2018. The event images a NW–SE striking fault segment within the crystalline basement, which might be related to the Fribourg Fault Zone. Finally, the ML 2.8 Grenchen earthquake of 2017 provides a rare example of shallow thrust faulting along the Jura fold-and-thrust belt, indicating contraction in the northwestern Alpine foreland of Switzerland.
    Description: Published
    Description: id 4
    Description: 4T. Sismicità dell'Italia
    Description: JCR Journal
    Keywords: Seismicity ; Focal mechanisms ; Seismotectonics ; Urnerboden ; Aar Massif ; Château-d’oex ; Préalpes ; Fribourg ; Jura fold-and-thrust belt ; 04.06. Seismology
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 47
    Publication Date: 2021-06-07
    Description: Domino effects; Short-term hazard and risk assessment; Time-dependent risk; Triggering effects
    Description: Published
    Description: 6T. Studi di pericolosità sismica e da maremoto
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: book chapter
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  • 48
    Publication Date: 2021-06-10
    Description: The deformation history of the Campi Flegrei caldera during the last decades consists of two large uplift events in 1970-72 and 1982-84, with ~ 3.5 m cumula-tive uplift, occurring at a rate of ~ 1 m/yr. Both events were accompanied by seismic activity, gravity changes and compositional variations of volcanic gasesbut no eruption took place. During the following decades,the area has been slowly subsiding but minor uplift episodes (~ a few cm), seismic swarms and changes in degassing activitytook place, showing that the area persistedin a near-critical state.Since 2004, ground deformation resumed, although at a slower rate, totaling a displacement of ~ 0.6 m at the time we write(2019). In this chapter,we present a retrospective analysis of ground deformationleading to acritical re-evaluationof the 1982-84 uplift and of the following deflation, employing the most updated modeling techniques. Deformation and gravity data provide important constraints on depth, volume, mass density and dislocation mechanisms accompanying mag-ma emplacement processes but the correct evaluation of these parameters is strongly conditioned by simplifying assumptions built in the different inversion procedures: in particular, the inferred depth ranges from 5.5 km to less than 3 km and the intrusion density ranges from values pertinent to aqueous fluids to typical magmatic values. This review depicts the salient phases of the deformationhistory of this densely populated and high risk volcanic area, helping to address debated issues, such as the role of the magmatic system, and theirinteraction with the shal-lower hydrothermal system.In spite of the mentioned difficulties, the following conclusion may be considered as firmly established: during 1982-84 a magmatic intrusion took place, and the subsequent complex deformation history (1985-2010) was mainly controlled by the exsolution of volatiles withmagmatic origin and their interaction with a shallow hydrothermal system. However, data collected af-ter 2011 were modelled in terms of a deeperinflating source of deformation, pos-sibly resulting froma resumed magmatic recharge at depth.
    Description: Submitted
    Description: 4V. Processi pre-eruttivi
    Keywords: Campi Flegrei ; volcanoes
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: book chapter
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  • 49
    Publication Date: 2021-06-22
    Description: This paper presents an overview of the geophysical activities for the seismic microzonation of 138 municipalities belonging to four Italian regions (Abruzzo, Lazio, Marche and Umbria) that were severely damaged by the seismic sequence of Central Italy (August 2016–January 2017). This study is the result of a collaborative effort between research Institutions and professional geologists with the support of local Administrations and the Italian Civil Protection Department and sets an unprecedented large-scale example of geophysical investigations supporting detailed seismic microzonation studies. This manuscript presents the methodological approach adopted for the geophysical activities, including the technical protocols and procedures, the best practices, the final products and the results supporting a detailed microzonation study of III level. The first step of the study was the collection and critical review of all available geophysical and geological information for planning the new geophysical surveys (specifically their type and location), in order to assess the subsoil geometry and the seismic characterization of the areas under investigation. Integration with the newly acquired geophysical data allowed the identification of zones with homogeneous local seismic hazard as well as the reference seismo-stratigraphy for each area, defining for each geological unit the ranges of the relevant properties in seismic amplification studies: layering and thicknesses, density, P-wave and S-wave seismic velocity. We also present a few representative case studies illustrating the geophysical investigation for different geomorphological situations. These examples, together with the findings of the entire project, are discussed to point out the strength points and the criticalities, as well as the necessary requirements in the application of geophysical methods to detailed microzonation studies.
    Description: Published
    Description: 5475–5502
    Description: 5T. Sismologia, geofisica e geologia per l'ingegneria sismica
    Description: JCR Journal
    Keywords: Large-scale microzonation intervention ; Central Italy 2016 earthquake ; Extensive geophysical prospecting ; Site characterization ; Geophysical protocols of measurements ; Seismic Microzonation
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 50
    Publication Date: 2021-02-14
    Description: The tectonic opening of the Fram Strait (FS) was critical to the water exchange between the Atlantic Ocean and the Arctic Ocean, and caused the transition from a restricted to a ventilated Arctic Ocean during early Miocene. If and how the water exchange between the Arctic Ocean and the North Atlantic influenced the global current system is still disputed. We apply a fully coupled atmosphere–ocean–sea-ice model to investigate stratification and ocean circulation in the Arctic Ocean in response to the opening of the FS during early-to-middle Miocene. Progressive widening of the FS gateway in our simulation causes a moderate warming, while salinity conditions in the Nordic Seas remain similar. On the contrary, with increasing FS width, Arctic temperatures remain unchanged and salinity changes appear to steadily become stronger. For a sill depth of ~ 1500 m, we achieve ventilation of the Arctic Ocean due to enhanced import of saline Atlantic water through an FS width of ~ 105 km. Moreover, at this width and depth, we detect a modern-like three-layer stratification in the Arctic Ocean. The exchange flow through FS is characterized by vertical separation of a low-salinity cold outflow from the Arctic Ocean confined to a thin upper layer, an intermediate saline inflow from the Atlantic Ocean below, and a cold bottom Arctic outflow. Using a significantly shallower and narrower FS during the early Miocene, our study suggests that the ventilation mechanisms and stratification in the Arctic Ocean are comparable to the present-day characteristics.
    Repository Name: EPIC Alfred Wegener Institut
    Type: Article , isiRev
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  • 51
    facet.materialart.
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    Springer
    In:  EPIC3Proceedings of the 14th International Conference on Vibration Problems. Lecture Notes in Mechanical Engineering, 14th International Conference on Vibration Problems, Singapore, Springer, pp. 1117-1125, ISBN: 978-981-15-8049-9
    Publication Date: 2021-01-18
    Description: Structures can be characterized by their natural vibration. If the associated eigenfrequencies correspond to external, exciting vibration frequencies, high vibration amplitudes can occur which might cause structural damage. Therefore, heavy and costly damping mechanisms are often employed to prevent high vibration amplitudes. Natural structures are often highly optimized. The silicate shells of marine plankton organisms, for example, serve already as inspiration for lightweight construction owing to their high stiffness and strength at low mass. Moreover, the irregularities of their honeycomb and lattice structures are expected to have a strong impact on the vibration characteristics. In this investigation, the eigenfrequencies of different plates with regular patterns were compared to irregular plates of Voronoi cells. The irregular Voronoi plates were designed using evolutionary strategic optimization. The results showed significantly higher first eigenfrequencies of the irregular structures compared to regular structures of the same mass.
    Repository Name: EPIC Alfred Wegener Institut
    Type: Inbook , peerRev
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  • 52
    Publication Date: 2021-03-30
    Description: In the past two decades, most of the steps in a macromolecular crystallography experiment have undergone tremendous development with respect to speed, feasibility and increase of throughput. The part of the experimental workflow that is still a bottleneck, despite significant efforts, involves the manipulation and harvesting of the crystals for the diffraction experiment. Here, a novel low‐cost device is presented that functions as a cover for 96‐well crystallization plates. This device enables access to the individual experiments one at a time by its movable parts, while minimizing evaporation of all other experiments of the plate. In initial tests, drops of many typically used crystallization cocktails could be successfully protected for up to 6 h. Therefore, the manipulation and harvesting of crystals is straightforward for the experimenter, enabling significantly higher throughput. This is useful for many macromolecular crystallography experiments, especially multi‐crystal screening campaigns.
    Description: A simple and low‐cost device has been developed to minimize evaporation in microtiter plates for easy crystal handling and harvesting. image
    Keywords: 548 ; evaporation reduction ; crystal handling ; crystal harvesting ; crystallographic fragment screening
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  • 53
    Publication Date: 2021-03-30
    Description: Multiple‐Edge Anomalous Diffraction (MEAD) has been applied to various quaternary sulfosalts belonging to the adamantine compound family in order to validate the distribution of copper, zinc and iron cations in the structure. Semiconductors from this group of materials are promising candidates for photovoltaic applications. Their properties strongly depend on point defects, in particular related to cation order–disorder. However, Cu+, Zn2+ and Fe2+ have very similar scattering factors and are all but indistinguishable in usual X‐ray diffraction experiments. Anomalous diffraction utilizes the dependency of the atomic scattering factors f′ and f′′ of the energy of the radiation, especially close to the element‐specific absorption edges. In the MEAD technique, individual Bragg peaks are tracked over an absorption edge. The intensity changes depending on the structure factor can be highly characteristic for Miller indices selected for a specific structural problem, but require very exact measurements. Beamline KMC‐2 at synchrotron BESSY II, Berlin, has been recently upgraded for this technique. Anomalous X‐ray powder diffraction and XAFS compliment the data. Application of this technique confirmed established cation distribution in Cu2ZnSnSe4 (CZTSe) and Cu2FeSnS4 (CFTS). In contrast to the literature, cation distribution in Cu2ZnSiSe4 (CZSiSe) is shown to adopt a highly ordered wurtz‐kesterite structure type.
    Description: Multiple‐Edge Anomalous Diffraction (MEAD) has been applied to various quaternary sulfosalts belonging to the adamantine compound family in order to validate the distribution of copper, zinc and iron cations in the structure. Application of this technique confirms established cation distribution in Cu2ZnSnSe4 (CZTSe) and Cu2FeSnS4 (CFTS), but in Cu2ZnSiSe4 (CZSiSe) the cation distribution is shown to adopt a highly ordered wurtz‐kesterite structure type in contrast to the literature. image
    Keywords: 548 ; synchrotron ; anomalous diffraction ; semiconductor ; MEAD
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  • 54
    Publication Date: 2021-03-27
    Description: The growth of diffraction‐quality crystals and experimental phasing remain two of the main bottlenecks in protein crystallography. Here, the high‐affinity copper(II)‐binding tripeptide GHK was fused to the N‐terminus of a GFP variant and an MBP‐FG peptide fusion. The GHK tag promoted crystallization, with various residues (His, Asp, His/Pro) from symmetry molecules completing the copper(II) square‐pyramidal coordination sphere. Rapid structure determination by copper SAD phasing could be achieved, even at a very low Bijvoet ratio or after significant radiation damage. When collecting highly redundant data at a wavelength close to the copper absorption edge, residual S‐atom positions could also be located in log‐likelihood‐gradient maps and used to improve the phases. The GHK copper SAD method provides a convenient way of both crystallizing and phasing macromolecular structures, and will complement the current trend towards native sulfur SAD and MR‐SAD phasing.
    Description: A novel three‐residue tag containing the residues GHK that can be used to promote crystallization and in SAD phasing experiments using its tightly bound copper ion is described. image
    Keywords: 548 ; phasing ; crystallization ; GHK ; SAD
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  • 55
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    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-03-30
    Description: Recently, the authors reported on the development of crystallinity in mixed‐tacticity polyhydroxybutyrates. Comparable values reported in the literature vary depending on the manner of determination, the discrepancies being partially attributable to scattering from paracrystalline portions of the material. These portions can be qualified by peak profile fitting or quantified by allocation of scattered X‐ray intensities. However, the latter requires a good quality of the former, which in turn must additionally account for peak broadening inherent in the measurement setup, and due to limited crystallite sizes and the possible presence of microstrain. Since broadening due to microstrain and paracrystalline order both scale with scattering vector, they are easily confounded. In this work, a method to directionally discern these two influences on the peak shape in a Rietveld refinement is presented. Allocating intensities to amorphous, bulk and paracrystalline portions with changing tactic disturbance provided internal validations of the obtained directional numbers. In addition, the correlation between obtained thermal factors and Young's moduli, determined in earlier work, is discussed.
    Description: A method to robustly determine paracrystalline contents from Rietveld‐refined powder X‐ray data is presented and discussed for the example of mixed‐tacticity polyhydroxybutyrates. image
    Keywords: 548 ; polyhydroxybutyrates ; mixed tacticity ; paracrystallinity ; Rietveld refinement ; thermal factors
    Type: article
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  • 56
    Publication Date: 2021-03-27
    Description: Two evaluation concepts for nondestructive depth‐resolved X‐ray residual stress analysis in the near‐surface region of materials with cubic symmetry and nearly single crystalline structure are introduced by simulated examples. Both concepts are based on the same data acquisition strategy, which consists in the determination of lattice‐spacing depth profiles along the ⟨hkl⟩ poles by stepwise sample rotation around the scattering vector. Segmentation of these profiles parallel to the sample surface provides the lattice strain state as a function of depth. The first evaluation concept extends the crystallite group method developed for materials with pronounced crystallographic texture by the feature of depth resolution and can be applied to samples with arbitrary orientation. The second evaluation concept, which adapts the linear regression approach of the sin2ψ method for the case of single crystalline materials, is restricted to samples with (001) orientation. The influence of the strain‐free lattice parameter a0 on residual stress analysis using both evaluation concepts is discussed on the basis of explicitly derived relations.
    Description: Two data evaluation concepts are proposed for nondestructive and depth‐resolved X‐ray residual stress analysis by means of energy‐dispersive diffraction on materials featuring cubic symmetry and a nearly single crystalline structure. image
    Keywords: 548 ; residual stress ; X‐ray diffraction ; depth‐resolved analysis ; mosaic crystals
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  • 57
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    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-03-30
    Description: Dichroism is one of the most important optical effects in both the visible and the X‐ray range. Besides absorption, scattering can also contribute to dichroism. This paper demonstrates that, based on the example of polyimide, materials can show tiny dichroism even far from electronic resonances due to scattering. Although the effect is small, it can lead to a measurable polarization change and might have influence on highly sensitive polarimetric experiments.
    Description: Aligned molecules, for example in polyimide foils, lead to small dichroism even far from resonances, which can be revealed by high‐precision X‐ray polarimetry. image
    Keywords: 548 ; polyimide ; polarization ; X‐ray polarimetry ; wide‐angle scattering ; X‐ray dichroism
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  • 58
    Publication Date: 2021-03-27
    Description: The complete elastic stiffness tensor of thiourea has been determined from thermal diffuse scattering (TDS) using high‐energy photons (100 keV). Comparison with earlier data confirms a very good agreement of the tensor coefficients. In contrast with established methods to obtain elastic stiffness coefficients (e.g. Brillouin spectroscopy, inelastic X‐ray or neutron scattering, ultrasound spectroscopy), their determination from TDS is faster, does not require large samples or intricate sample preparation, and is applicable to opaque crystals. Using high‐energy photons extends the applicability of the TDS‐based approach to organic compounds which would suffer from radiation damage at lower photon energies.
    Description: The elastic stiffness coefficients of thiourea are determined from thermal diffuse scattering. image
    Keywords: 548 ; thermal diffuse scattering ; elastic stiffness ; thiourea
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  • 59
    Publication Date: 2021-07-03
    Description: X‐ray reflectivity (XRR) is a powerful and popular scattering technique that can give valuable insight into the growth behavior of thin films. This study shows how a simple artificial neural network model can be used to determine the thickness, roughness and density of thin films of different organic semiconductors [diindenoperylene, copper(II) phthalocyanine and α‐sexithiophene] on silica from their XRR data with millisecond computation time and with minimal user input or a priori knowledge. For a large experimental data set of 372 XRR curves, it is shown that a simple fully connected model can provide good results with a mean absolute percentage error of 8–18% when compared with the results obtained by a genetic least mean squares fit using the classical Parratt formalism. Furthermore, current drawbacks and prospects for improvement are discussed.
    Description: Artificial neural networks trained with simulated data are shown to correctly and quickly determine film parameters from experimental X‐ray reflectivity curves.
    Keywords: 548 ; X‐ray reflectivity ; machine learning ; organic semi‐conductors ; neural networks
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  • 60
    facet.materialart.
    Unknown
    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-06-05
    Description: Coordinate‐free expressions for the form factors of arbitrary polygons and polyhedra are derived using the divergence theorem and Stokes's theorem. Apparent singularities, all removable, are discussed in detail. Cancellation near the singularities causes a loss of precision that can be avoided by using series expansions. An important application domain is small‐angle scattering by nanocrystals.
    Description: Coordinate‐free expressions for the form factors of arbitrary polygons and polyhedra are derived using the divergence theorem and Stokes's theorem. Series expansions are used to ensure numeric precision close to apparent singularities. image
    Keywords: 548 ; form factors ; polyhedra ; Fourier shape transform
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  • 61
    Publication Date: 2021-06-30
    Description: ROBL‐II provides four different experimental stations to investigate actinide and other alpha‐ and beta‐emitting radionuclides at the new EBS storage ring of ESRF within an energy range of 3 to 35 keV. The XAFS station consists of a highly automatized, high sample throughput installation in a glovebox, to measure EXAFS and conventional XANES of samples routinely at temperatures down to 10 K, and with a detection limit in the sub‐p.p.m. range. The XES station with its five bent‐crystal analyzer, Johann‐type setup with Rowland circles of 1.0 and 0.5 m radii provides high‐energy resolution fluorescence detection (HERFD) for XANES, XES, and RIXS measurements, covering both actinide L and M edges together with other elements accessible in the 3 to 20 keV energy range. The six‐circle heavy duty goniometer of XRD‐1 is equipped for both high‐resolution powder diffraction as well as surface‐sensitive CTR and RAXR techniques. Single crystal diffraction, powder diffraction with high temporal resolution, as well as X‐ray tomography experiments can be performed at a Pilatus 2M detector stage (XRD‐2). Elaborate radioprotection features enable a safe and easy exchange of samples between the four different stations to allow the combination of several methods for an unprecedented level of information on radioactive samples for both fundamental and applied actinide and environmental research.
    Description: ROBL‐II at ESRF provides four experimental stations to investigate actinides with X‐ray absorption and emission spectroscopy, and with surface, high‐resolution powder, and single‐crystal X‐ray diffractometry.
    Keywords: 549 ; actinides ; EXAFS ; XANES ; HERFD‐XANES ; XAS ; XES ; RIXS ; XRD ; CTR ; RAXR ; surface diffraction
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  • 62
    Publication Date: 2021-03-30
    Description: The ATSAS software suite encompasses a number of programs for the processing, visualization, analysis and modelling of small‐angle scattering data, with a focus on the data measured from biological macromolecules. Here, new developments in the ATSAS 3.0 package are described. They include IMSIM, for simulating isotropic 2D scattering patterns; IMOP, to perform operations on 2D images and masks; DATRESAMPLE, a method for variance estimation of structural invariants through parametric resampling; DATFT, which computes the pair distance distribution function by a direct Fourier transform of the scattering data; PDDFFIT, to compute the scattering data from a pair distance distribution function, allowing comparison with the experimental data; a new module in DATMW for Bayesian consensus‐based concentration‐independent molecular weight estimation; DATMIF, an ab initio shape analysis method that optimizes the search model directly against the scattering data; DAMEMB, an application to set up the initial search volume for multiphase modelling of membrane proteins; ELLLIP, to perform quasi‐atomistic modelling of liposomes with elliptical shapes; NMATOR, which models conformational changes in nucleic acid structures through normal mode analysis in torsion angle space; DAMMIX, which reconstructs the shape of an unknown intermediate in an evolving system; and LIPMIX and BILMIX, for modelling multilamellar and asymmetric lipid vesicles, respectively. In addition, technical updates were deployed to facilitate maintainability of the package, which include porting the PRIMUS graphical interface to Qt5, updating SASpy – a PyMOL plugin to run a subset of ATSAS tools – to be both Python 2 and 3 compatible, and adding utilities to facilitate mmCIF compatibility in future ATSAS releases. All these features are implemented in ATSAS 3.0, freely available for academic users at https://www.embl‐hamburg.de/biosaxs/software.html.
    Description: ATSAS is a comprehensive software suite for the processing, visualization, analysis and modelling of small‐angle scattering data. This article describes developments in the ATSAS 3.0 release, including new programs for data simulation and for the structural modelling of lipids, nucleic acids and polydisperse systems. image
    Keywords: 548 ; small‐angle scattering ; data analysis ; biological macromolecules ; structural modelling ; ATSAS
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  • 63
    Publication Date: 2021-03-27
    Description: Serial crystallography records still diffraction patterns from single, randomly oriented crystals, then merges data from hundreds or thousands of them to form a complete data set. To process the data, the diffraction patterns must first be indexed, equivalent to determining the orientation of each crystal. A novel automatic indexing algorithm is presented, which in tests usually gives significantly higher indexing rates than alternative programs currently available for this task. The algorithm does not require prior knowledge of the lattice parameters but can make use of that information if provided, and also allows indexing of diffraction patterns generated by several crystals in the beam. Cases with a small number of Bragg spots per pattern appear to particularly benefit from the new approach. The algorithm has been implemented and optimized for fast execution, making it suitable for real‐time feedback during serial crystallography experiments. It is implemented in an open‐source C++ library and distributed under the LGPLv3 licence. An interface to it has been added to the CrystFEL software suite.
    Description: A description and evaluation are given of XGANDALF, extended gradient descent algorithm for lattice finding, an algorithm developed for fast and accurate indexing of snapshot diffraction patterns. image
    Keywords: 548 ; indexing ; XGANDALF ; CrystFEL ; multiple lattices ; serial crystallography
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  • 64
    Publication Date: 2021-03-27
    Description: A crystallographic indexing algorithm, pinkIndexer, is presented for the analysis of snapshot diffraction patterns. It can be used in a variety of contexts including measurements made with a monochromatic radiation source, a polychromatic source or with radiation of very short wavelength. As such, the algorithm is particularly suited to automated data processing for two emerging measurement techniques for macromolecular structure determination: serial pink‐beam X‐ray crystallography and serial electron crystallography, which until now lacked reliable programs for analyzing many individual diffraction patterns from crystals of uncorrelated orientation. The algorithm requires approximate knowledge of the unit‐cell parameters of the crystal, but not the wavelengths associated with each Bragg spot. The use of pinkIndexer is demonstrated by obtaining 1005 lattices from a published pink‐beam serial crystallography data set that had previously yielded 140 indexed lattices. Additionally, in tests on experimental serial crystallography diffraction data recorded with quasi‐monochromatic X‐rays and with electrons the algorithm indexed more patterns than other programs tested.
    Description: pinkIndexer, an algorithm developed for indexing of snapshot diffraction patterns recorded with pink‐beam X‐rays, monochromatic X‐rays and electrons, is described and its use evaluated. image
    Keywords: 548 ; indexing ; pinkIndexer ; CrystFEL ; pink X‐ray beam ; serial electron diffraction
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  • 65
    facet.materialart.
    Unknown
    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-06-17
    Description: CRM1 is a nuclear export receptor that has been intensively targeted over the last decade for the development of antitumor and antiviral drugs. Structural analysis of several inhibitor compounds bound to CRM1 revealed that their mechanism of action relies on the covalent modification of a critical cysteine residue (Cys528 in the human receptor) located in the nuclear export signal‐binding cleft. This study presents the crystal structure of human CRM1, covalently modified by 2‐mercaptoethanol on Cys528, in complex with RanGTP at 2.58 Å resolution. The results demonstrate that buffer components can interfere with the characterization of cysteine‐dependent inhibitor compounds.
    Description: The covalent modification of human CRM1 by 2‐mercaptoethanol interferes with the characterization of cysteine‐dependent inhibitor compounds. image
    Keywords: 548 ; nuclear export ; cancer ; exportin 1 ; cysteine modification
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  • 66
    Publication Date: 2021-06-26
    Description: Owing to the development of X‐ray focusing optics during the past decades, synchrotron‐based X‐ray microscopy techniques allow the study of specimens with unprecedented spatial resolution, down to 10 nm, using soft and medium X‐ray photon energies, though at the expense of the field of view (FOV). One of the approaches to increase the FOV to square millimetres is raster‐scanning of the specimen using a single nanoprobe; however, this results in a long data acquisition time. This work employs an array of inclined biconcave parabolic refractive multi‐lenses (RMLs), fabricated by deep X‐ray lithography and electroplating to generate a large number of long X‐ray foci. Since the FOV is limited by the pattern height if a single RML is used by impinging X‐rays parallel to the substrate, many RMLs at regular intervals in the orthogonal direction were fabricated by tilted exposure. By inclining the substrate correspondingly to the tilted exposure, 378000 X‐ray line foci were generated with a length in the centimetre range and constant intervals in the sub‐micrometre range. The capability of this new X‐ray focusing device was first confirmed using ray‐tracing simulations and then using synchrotron radiation at BL20B2 of SPring‐8, Japan. Taking account of the fact that the refractive lens is effective for focusing high‐energy X‐rays, the experiment was performed with 35 keV X‐rays. Next, by scanning a specimen through the line foci, this device was used to perform large FOV pixel super‐resolution scanning transmission hard X‐ray microscopy (PSR‐STHXM) with a 780 ± 40 nm spatial resolution within an FOV of 1.64 cm × 1.64 cm (limited by the detector area) and a total scanning time of 4 min. Biomedical implant abutments fabricated via selective laser melting using Ti–6Al–4V medical alloy were measured by PSR‐STHXM, suggesting its unique potential for studying extended and thick specimens. Although the super‐resolution function was realized in one dimension in this study, it can be expanded to two dimensions by aligning a pair of presented devices orthogonally.
    Description: A new X‐ray focusing device generates hundreds of thousands of line foci, periodically spaced in the sub‐micrometre range, with centimetre length. It enables to achieve large FOV pixel super‐resolution scanning transmission hard X‐ray microscopy. image
    Keywords: 502.82 ; inclined refractive X‐ray multi‐lens array ; pixel super‐resolution ; scanning transmission hard X‐ray microscopy ; deep X‐ray lithography and electroplating
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  • 67
    Publication Date: 2021-07-02
    Description: A new concept for temporal gating of synchrotron X‐ray pulses based on laser‐induced thermal transient gratings is presented. First experimental tests of the concept yield a diffraction efficiency of 0.18%; however, the calculations indicate a theoretical efficiency and contrast of 〉30% and 10−5, respectively. The full efficiency of the pulse picker has not been reached yet due to a long‐range thermal deformation of the sample after absorption of the excitation laser. This method can be implemented in a broad spectral range (100 eV to 20 keV) and is only minimally invasive to an existing setup.
    Description: A new concept for temporal gating of synchrotron X‐ray pulses based on laser‐induced thermal transient gratings is presented.
    Keywords: 548 ; synchrotron ; time‐resolved ; thermal deformation ; transient grating ; pulse picking
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  • 68
    Publication Date: 2021-06-06
    Description: The time‐resolved hard X‐ray diffraction endstation KMC‐3 XPP for optical pump/X‐ray probe experiments at the electron storage ring BESSY II is dedicated to investigating the structural response of thin film samples and heterostructures after their excitation with ultrashort laser pulses and/or electric field pulses. It enables experiments with access to symmetric and asymmetric Bragg reflections via a four‐circle diffractometer and it is possible to keep the sample in high vacuum and vary the sample temperature between ∼15 K and 350 K. The femtosecond laser system permanently installed at the beamline allows for optical excitation of the sample at 1028 nm. A non‐linear optical setup enables the sample excitation also at 514 nm and 343 nm. A time‐resolution of 17 ps is achieved with the `low‐α' operation mode of the storage ring and an electronic variation of the delay between optical pump and hard X‐ray probe pulse conveniently accesses picosecond to microsecond timescales. Direct time‐resolved detection of the diffracted hard X‐ray synchrotron pulses use a gated area pixel detector or a fast point detector in single photon counting mode. The range of experiments that are reliably conducted at the endstation and that detect structural dynamics of samples excited by laser pulses or electric fields are presented.
    Description: The KMC‐3 XPP endstation of the synchrotron BESSY II is dedicated to time‐resolved studies of structural dynamics of matter upon optical and/or electrical excitation using hard X‐ray diffraction with an accessible time range from 17 ps to several microseconds. image
    Keywords: 548 ; beamline instrumentation ; time‐resolved X‐ray diffraction ; optical excitation ; thermal transport ; ferroelectric switching
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  • 69
    Publication Date: 2021-03-27
    Description: The crystal structures of sodium ethoxide (sodium ethanolate, NaOEt), sodium n‐propoxide (sodium n‐propanolate, NaOnPr), sodium n‐butoxide (sodium n‐butanolate, NaOnBu) and sodium n‐pentoxide (sodium n‐amylate, NaOnAm) were determined from powder X‐ray diffraction data. NaOEt crystallizes in space group P421m, with Z = 2, and the other alkoxides crystallize in P4/nmm, with Z = 2. To resolve space‐group ambiguities, a Bärnighausen tree was set up, and Rietveld refinements were performed with different models. In all structures, the Na and O atoms form a quadratic net, with the alkyl groups pointing outwards on both sides (anti‐PbO type). The alkyl groups are disordered. The disorder becomes even more pronounced with increasing chain length. Recrystallization from the corresponding alcohols yielded four sodium alkoxide solvates: sodium ethoxide ethanol disolvate (NaOEt·2EtOH), sodium n‐propoxide n‐propanol disolvate (NaOnPr·2nPrOH), sodium isopropoxide isopropanol pentasolvate (NaOiPr·5iPrOH) and sodium tert‐amylate tert‐amyl alcohol monosolvate (NaOtAm·tAmOH, tAm = 2‐methyl‐2‐butyl). Their crystal structures were determined by single‐crystal X‐ray diffraction. All these solvates form chain structures consisting of Na+, –O− and –OH groups, encased by alkyl groups. The hydrogen‐bond networks diverge widely among the solvate structures. The hydrogen‐bond topology of the iPrOH network in NaOiPr·5iPrOH shows branched hydrogen bonds and differs considerably from the networks in pure crystalline iPrOH.
    Description: The crystal structures of NaOEt, NaOPr, NaOBu and NaOAm (Am = amyl = pentyl) were determined from powder data. These compounds crystallize in an anti‐PbO structure in the space groups P21m and P4/nmm. Additionally, solvates with the composition NaOEt·2EtOH, NaOPr·2PrOH, NaOiPr·5iPrOH and NaOtAm·tAmOH were synthesized, and their structures were determined from single crystals. They form interesting chain structures of different compositions and topologies. image
    Keywords: 548 ; sodium alkoxide ; powder data ; solvate ; isopropanol ; Bärnighausen tree ; PXRD
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  • 70
    facet.materialart.
    Unknown
    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-03-27
    Description: Small‐angle X‐ray scattering from GaN nanowires grown on Si(111) is measured in the grazing‐incidence geometry and modelled by means of a Monte Carlo simulation that takes into account the orientational distribution of the faceted nanowires and the roughness of their side facets. It is found that the scattering intensity at large wavevectors does not follow Porod's law I(q) ∝ q−4. The intensity depends on the orientation of the side facets with respect to the incident X‐ray beam. It is maximum when the scattering vector is directed along a facet normal, reminiscent of surface truncation rod scattering. At large wavevectors q, the scattering intensity is reduced by surface roughness. A root‐mean‐square roughness of 0.9 nm, which is the height of just 3–4 atomic steps per micrometre‐long facet, already gives rise to a strong intensity reduction.
    Description: The intensity of small‐angle X‐ray scattering from GaN nanowires on Si(111) depends on the orientation of the side facets with respect to the incident beam. This reminiscence of truncation rod scattering gives rise to a deviation from Porod's law. A roughness of just 3–4 atomic steps per micrometre‐long side facet notably changes the intensity curves. image
    Keywords: 548 ; nanowires ; Porod's law ; facet truncation rods ; small‐angle X‐ray scattering ; SAXS ; grazing‐incidence small‐angle X‐ray scattering ; GISAXS
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  • 71
    facet.materialart.
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    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-06-28
    Description: Recent developments in cryogenic electron microscopy (cryo‐EM) have enabled structural studies of large macromolecular complexes at resolutions previously only attainable using macromolecular crystallography. Although a number of methods can already assist in de novo building of models into high‐resolution cryo‐EM maps, automated and reliable map interpretation remains a challenge. Presented here is a systematic study of the accuracy of models built into cryo‐EM maps using ARP/wARP. It is demonstrated that the local resolution is a good indicator of map interpretability, and for the majority of the test cases ARP/wARP correctly builds 90% of main‐chain fragments in regions where the local resolution is 4.0 Å or better. It is also demonstrated that the coordinate accuracy for models built into cryo‐EM maps is comparable to that of X‐ray crystallographic models at similar local cryo‐EM and crystallographic resolutions. The model accuracy also correlates with the refined atomic displacement parameters.
    Keywords: 548 ; ARP/wARP ; model building ; cryo‐EM ; model accuracy ; sequence assignment
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  • 72
    Publication Date: 2021-06-05
    Description: Carbonates containing CO4 groups as building blocks have recently been discovered. A new orthocarbonate, Sr2CO4 is synthesized at 92 GPa and at a temperature of 2500 K. Its crystal structure was determined by in situ synchrotron single‐crystal X‐ray diffraction, selecting a grain from a polycrystalline sample. Strontium orthocarbonate crystallizes in the orthorhombic crystal system (space group Pnma) with CO4, SrO9 and SrO11 polyhedra as the main building blocks. It is isostructural to Ca2CO4. DFT calculations reproduce the experimental findings very well and have, therefore, been used to predict the equation of state, Raman and IR spectra, and to assist in the discussion of bonding in this compound.
    Description: A new orthocarbonate, Sr2CO4, was synthesized under extreme pressure and temperature conditions of 92 GPa and 2500 K, respectively. The crystal structure of the compound s fully characterized in situ by synchrotron single‐crystal X‐ray diffraction and DFT calculations were employed to provide insight into its equation of state, Raman and IR spectra, and bonding. image
    Keywords: 548 ; orthocarbonates ; crystal structure ; single‐crystal X‐ray diffraction ; high pressure ; Sr2CO4
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  • 73
    Publication Date: 2021-06-28
    Description: Small‐angle X‐ray scattering (SAXS) is an established method for studying nanostructured systems and in particular biological macromolecules in solution. To obtain element‐specific information about the sample, anomalous SAXS (ASAXS) exploits changes of the scattering properties of selected atoms when the energy of the incident X‐rays is close to the binding energy of their electrons. While ASAXS is widely applied to condensed matter and inorganic systems, its use for biological macromolecules is challenging because of the weak anomalous effect. Biological objects are often only available in small quantities and are prone to radiation damage, which makes biological ASAXS measurements very challenging. The BioSAXS beamline P12 operated by the European Molecular Biology Laboratory (EMBL) at the PETRA III storage ring (DESY, Hamburg) is dedicated to studies of weakly scattering objects. Here, recent developments at P12 allowing for ASAXS measurements are presented. The beamline control, data acquisition and data reduction pipeline of the beamline were adapted to conduct ASAXS experiments. Modelling tools were developed to compute ASAXS patterns from atomic models, which can be used to analyze the data and to help designing appropriate data collection strategies. These developments are illustrated with ASAXS experiments on different model systems performed at the P12 beamline.
    Keywords: 548 ; ASAXS ; biological SAXS ; metalloproteins ; gold nanoparticles ; anomalous scattering ; beamline development
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  • 74
    facet.materialart.
    Unknown
    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-06-27
    Description: Binary III–V nitrides such as AlN, GaN and InN in the wurtzite‐type structure have long been considered as potent semiconducting materials because of their optoelectronic properties, amongst others. With rising concerns over the utilization of scarce elements, a replacement of the trivalent cations by others in ternary and multinary nitrides has led to the development of different variants of nitrides and oxide nitrides crystallizing in lower‐symmetry variants of wurtzite. This work presents the symmetry relationships between these structural types specific to nitrides and oxide nitrides and updates some prior work on this matter. The non‐existence of compounds crystallizing in Pmc21, formally the highest subgroup of the wurtzite type fulfilling Pauling's rules for 1:1:2 stoichiometries, has been puzzling scientists for a while; a rationalization is given, from a crystallographic basis, of why this space group is unlikely to be adopted.
    Keywords: 548 ; group–subgroup relationships ; nitride materials ; wurtzite type
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  • 75
    facet.materialart.
    Unknown
    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-06-20
    Description: An approach for the comparison of pair distribution functions (PDFs) has been developed using a similarity measure based on cross‐correlation functions. The PDF is very sensitive to changes in the local structure, i.e. small deviations in the structure can cause large signal shifts and significant discrepancies between the PDFs. Therefore, a comparison based on pointwise differences (e.g. R values and difference curves) may lead to the assumption that the investigated PDFs as well as the corresponding structural models are not in agreement at all, whereas a careful visual inspection of the investigated structural models and corresponding PDFs may reveal a relatively good match. To quantify the agreement of different PDFs for those cases an alternative approach is introduced: the similarity measure based on cross‐correlation functions. In this paper, the power of this application of the similarity measure to the analysis of PDFs is highlighted. The similarity measure is compared with the classical Rwp values as representative of the comparison based on pointwise differences as well as with the Pearson product‐moment correlation coefficient, using polymorph IV of barbituric acid as an example.
    Description: A novel approach to the quantification of the agreement between pair distribution functions by a similarity measure based on cross‐correlation functions is introduced and evaluated. image
    Keywords: 548 ; pair distribution functions ; similarity measures ; total scattering techniques ; cross‐correlation functions ; R values
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  • 76
    Publication Date: 2021-06-26
    Description: The high‐precision X‐ray diffraction setup for work with diamond anvil cells (DACs) in interaction chamber 2 (IC2) of the High Energy Density instrument of the European X‐ray Free‐Electron Laser is described. This includes beamline optics, sample positioning and detector systems located in the multipurpose vacuum chamber. Concepts for pump–probe X‐ray diffraction experiments in the DAC are described and their implementation demonstrated during the First User Community Assisted Commissioning experiment. X‐ray heating and diffraction of Bi under pressure, obtained using 20 fs X‐ray pulses at 17.8 keV and 2.2 MHz repetition, is illustrated through splitting of diffraction peaks, and interpreted employing finite element modeling of the sample chamber in the DAC.
    Description: The high‐precision X‐ray diffraction (XRD) setup for work with diamond anvil cells (DACs) in Interaction Chamber 2 of the High Energy Density (HED) instrument of the European X‐ray Free‐Electron Laser is described. image
    Keywords: 548 ; diamond anvil cells ; X‐ray free‐electron lasers ; high‐precision X‐ray diffraction ; finite element modeling
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  • 77
    facet.materialart.
    Unknown
    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-06-26
    Description: The refractive index of a y‐cut SiO2 crystal surface is reconstructed from orientation‐dependent soft X‐ray reflectometry measurements in the energy range from 45 to 620 eV. Owing to the anisotropy of the crystal structure in the (100) and (001) directions, a significant deviation of the measured reflectance at the Si L2,3 and O K absorption edges is observed. The anisotropy in the optical constants reconstructed from these data is also confirmed by ab initio Bethe–Salpeter equation calculations for the O K edge. This new experimental data set expands the existing literature data for quartz crystal optical constants significantly, particularly in the near‐edge regions.
    Description: The refractive index of a y‐cut SiO2 crystal surface is reconstructed from polarization‐dependent soft X‐ray reflectometry measurements in the energy range from 45 to 620 eV. The reconstructed anisotropy in the optical constants is also confirmed by ab initio Bethe–Salpeter equation calculations of the O K edge. image
    Keywords: 548 ; optical constants ; quartz ; anisotropy ; soft X‐ray reflectometry
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  • 78
    Publication Date: 2021-07-05
    Description: Mixed ionic electronic conducting ceramics Nd6−yWO12−δ (δ is the oxygen deficiency) provide excellent stability in harsh environments containing strongly reactive gases such as CO2, CO, H2, H2O or H2S. Due to this chemical stability, they are promising and cost‐efficient candidate materials for gas separation, catalytic membrane reactors and protonic ceramic fuel cell technologies. As in La6−yWO12−δ, the ionic/electronic transport mechanism in Nd6−yWO12−δ is expected to be largely controlled by the crystal structure, the conclusive determination of which is still lacking. This work presents a crystallographic study of Nd5.8WO12−δ and molybdenum‐substituted Nd5.7W0.75Mo0.25O12−δ prepared by the citrate complexation route. High‐resolution synchrotron and neutron powder diffraction data were used in combined Rietveld refinements to unravel the crystal structure of Nd5.8WO12−δ and Nd5.7W0.75Mo0.25O12−δ. Both investigated samples crystallize in a defect fluorite crystal structure with space group Fm3m and doubled unit‐cell parameter due to cation ordering. Mo replaces W at both Wyckoff sites 4a and 48h and is evenly distributed, in contrast with La6−yWO12−δ. X‐ray absorption spectroscopy as a function of partial pressure pO2 in the near‐edge regions excludes oxidation state changes of Nd (Nd3+) and W (W6+) in reducing conditions: the enhanced hydrogen permeation, i.e. ambipolar conduction, observed in Mo‐substituted Nd6−yWO12−δ is therefore explained by the higher Mo reducibility and the creation of additional – disordered – oxygen vacancies.
    Description: The crystal structures of non‐substituted and Mo‐substituted neodymium tungstates are described in detail through neutron diffraction and high‐resolution X‐ray diffraction. Combined X‐ray and neutron diffraction refinements and electron probe micro‐analysis were employed to locate Mo atoms in the crystal structure of Nd6−yW1−zMozO12−δ (z = 0, 0.25), while X‐ray absorption spectroscopy in the near‐edge regions confirmed no changes in the oxidation states of Nd and W.
    Keywords: 548 ; powder diffraction ; mixed conductors ; X‐ray absorption spectroscopy (XAS) ; Nd6−yWO12−δ
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  • 79
    Publication Date: 2021-06-30
    Description: Niobium metal foils were heat‐treated at 900°C under different conditions and in situ investigated with time‐resolved X‐ray absorption fine‐structure (EXAFS and XANES) measurements. The present study aims to mimic the conditions usually applied for heat treatments of Nb materials used for superconducting radiofrequency cavities, in order to better understand the evolving processes during vacuum annealing as well as for heat treatments in controlled dilute gases. Annealing in vacuum in a commercially available cell showed a substantial amount of oxidation, so that a designated new cell was designed and realized, allowing treatments under clean high‐vacuum conditions as well as under well controllable gas atmospheres. The experiments performed under vacuum demonstrated that the original structure of the Nb foils is preserved, while a detailed evaluation of the X‐ray absorption fine‐structure data acquired during treatments in dilute air atmospheres (10−5 mbar to 10−3 mbar) revealed a linear oxidation with the time of the treatment, and an oxidation rate proportional to the oxygen (air) pressure. The structure of the oxide appears to be very similar to that of polycrystalline NbO. The cell also permits controlled exposures to other reactive gases at elevated temperatures; here the Nb foils were exposed to dilute nitrogen atmospheres after a pre‐conditioning of the studied Nb material for one hour under high‐vacuum conditions, in order to imitate typical conditions used for nitrogen doping of cavity materials. Clear structural changes induced by the N2 exposure were found; however, no evidence for the formation of niobium nitride could be derived from the EXAFS and XANES experiments. The presented results establish the feasibility to study the structural changes of the Nb materials in situ during heat treatments in reactive gases with temporal resolution, which are important to better understand the underlaying mechanisms and the dynamics of phase formation during those heat treatments in more detail.
    Keywords: 548 ; in situ EXAFS ; high temperature ; time‐resolved EXAFS ; niobium
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  • 80
    Publication Date: 2021-03-27
    Description: High‐pressure single‐crystal to 20 GPa and powder diffraction measurements to 50 GPa, show that the structure of Pb2SnO4 strongly distorts on compression with an elongation of one axis. A structural phase transition occurs between 10 GPa and 12 GPa, with a change of space group from Pbam to Pnam. The resistivity decreases by more than six orders of magnitude when pressure is increased from ambient conditions to 50 GPa. This insulator‐to‐semiconductor transition is accompanied by a reversible appearance change from transparent to opaque. Density functional theory‐based calculations show that at ambient conditions the channels in the structure host the stereochemically‐active Pb 6s2 lone electron pairs. On compression the lone electron pairs form bonds between Pb2+ ions. Also provided is an assignment of irreducible representations to the experimentally observed Raman bands.
    Description: The structure of Pb2SnO4 is found to strongly distort on compression and a structural phase transition with a change of space group from Pbam to Pnam occurs at ∼11 GPa. Our complementary DFT‐based calculations show that at ambient conditions, the channels in the structure host the stereochemically active Pb 6s2 lone electron pairs which form bonds between the Pb2+ ions with increasing pressure. image
    Keywords: 548 ; lead stannate (Pb2SnO4) ; density functional theory ; high‐pressure X‐ray diffraction ; pressure‐induced phase transition ; insulator–semiconductor transition
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  • 81
    facet.materialart.
    Unknown
    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-06-05
    Description: Heterovalent ternary nitrides are considered one of the promising classes of materials for photovoltaics, combining attractive physical properties with low toxicity and element abundance. One of the front‐runner systems under consideration is ZnSnN2. Although it is nominally a ternary compound, no clear crystallographic evidence for cation ordering has been observed so far. An attempt to elucidate this discrepancy [Quayle (2020). Acta Cryst. A76, 410–420] was the trigger for an intensive discussion between the authors, and an agreement was reached to elaborate on some points in order to set things in perspective. Rather than using a conventional comment–answer scheme, this is published in the form of a joint discussion to celebrate constructive criticism and collegiality.
    Description: A scientific exchange on an earlier paper [Quayle (2020). Acta Cryst. A76, 410–420] has led to the clarification of some of the points. image
    Keywords: 548 ; group–subgroup relationships ; nitride materials ; wurtzite type
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  • 82
    Publication Date: 2021-06-26
    Description: X‐SPEC is a high‐flux spectroscopy beamline at the KIT (Karlsruhe Institute of Technology) Synchrotron for electron and X‐ray spectroscopy featuring a wide photon energy range. The beamline is equipped with a permanent magnet undulator with two magnetic structures of different period lengths, a focusing variable‐line‐space plane‐grating monochromator, a double‐crystal monochromator and three Kirkpatrick–Baez mirror pairs. By selectively moving these elements in or out of the beam, X‐SPEC is capable of covering an energy range from 70 eV up to 15 keV. The flux of the beamline is maximized by optimizing the magnetic design of the undulator, minimizing the number of optical elements and optimizing their parameters. The beam can be focused into two experimental stations while maintaining the same spot position throughout the entire energy range. The first experimental station is optimized for measuring solid samples under ultra‐high‐vacuum conditions, while the second experimental station allows in situ and operando studies under ambient conditions. Measurement techniques include X‐ray absorption spectroscopy (XAS), extended X‐ray absorption fine structure (EXAFS), photoelectron spectroscopy (PES) and hard X‐ray PES (HAXPES), as well as X‐ray emission spectroscopy (XES) and resonant inelastic X‐ray scattering (RIXS).
    Description: X‐SPEC is a high‐flux undulator beamline for electron and X‐ray spectroscopy with an energy range from 70 eV to 15 keV. It offers X‐ray absorption spectroscopy (XAS), extended X‐ray absorption fine structure (EXAFS), photoelectron spectroscopy (PES) and hard X‐ray PES (HAXPES), as well as X‐ray emission spectroscopy (XES) and resonant inelastic X‐ray scattering (RIXS) for in vacuo, in situ and operando sample environments. image
    Keywords: 548 ; undulator beamline ; soft X‐ray ; tender X‐ray ; hard X‐ray ; in situ ; operando ; HAXPES ; RIXS ; XAS ; XES
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  • 83
    facet.materialart.
    Unknown
    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-06-26
    Description: A method for the ab initio crystal structure determination of organic compounds by a fit to the pair distribution function (PDF), without prior knowledge of lattice parameters and space group, has been developed. The method is called `PDF‐Global‐Fit' and is implemented by extension of the program FIDEL (fit with deviating lattice parameters). The structure solution is based on a global optimization approach starting from random structural models in selected space groups. No prior indexing of the powder data is needed. The new method requires only the molecular geometry and a carefully determined PDF. The generated random structures are compared with the experimental PDF and ranked by a similarity measure based on cross‐correlation functions. The most promising structure candidates are fitted to the experimental PDF data using a restricted simulated annealing structure solution approach within the program TOPAS, followed by a structure refinement against the PDF to identify the correct crystal structure. With the PDF‐Global‐Fit it is possible to determine the local structure of crystalline and disordered organic materials, as well as to determine the local structure of unindexable powder patterns, such as nanocrystalline samples, by a fit to the PDF. The success of the method is demonstrated using barbituric acid as an example. The crystal structure of barbituric acid form IV solved and refined by the PDF‐Global‐Fit is in excellent agreement with the published crystal structure data.
    Keywords: 548 ; pair distribution function analysis ; structure determination ; total scattering technique ; similarity measures ; PDF‐Global‐Fit
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  • 84
    Publication Date: 2021-07-01
    Description: Vibrio species play a crucial role in maintaining the carbon and nitrogen balance between the oceans and the land through their ability to employ chitin as a sole source of energy. This study describes the structural basis for the action of the GH20 β‐N‐acetylglucosaminidase (VhGlcNAcase) in chitin metabolism by Vibrio campbellii (formerly V. harveyi) strain ATCC BAA‐1116. Crystal structures of wild‐type VhGlcNAcase in the absence and presence of the sugar ligand, and of the unliganded D437A mutant, were determined. VhGlcNAcase contains three distinct domains: an N‐terminal carbohydrate‐binding domain linked to a small α+β domain and a C‐terminal (β/α)8 catalytic domain. The active site of VhGlcNAcase has a narrow, shallow pocket that is suitable for accommodating a small chitooligosaccharide. VhGlcNAcase is a monomeric enzyme of 74 kDa, but its crystal structures show two molecules of enzyme per asymmetric unit, in which Gln16 at the dimeric interface of the first molecule partially blocks the entrance to the active site of the neighboring molecule. The GlcNAc unit observed in subsite −1 makes exclusive hydrogen bonds to the conserved residues Arg274, Tyr530, Asp532 and Glu584, while Trp487, Trp546, Trp582 and Trp505 form a hydrophobic wall around the −1 GlcNAc. The catalytic mutants D437A/N and E438A/Q exhibited a drastic loss of GlcNAcase activity, confirming the catalytic role of the acidic pair (Asp437–Glu438).
    Description: Crystal structures of a GH20 β‐N‐acetylglucosaminidase from V. campbellii reveal substrate specificity in chitin utilization.
    Keywords: 577.14 ; GH20 β‐N‐acetylglucosaminidase ; chitin recycling ; Vibrio spp ; marine bacteria
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  • 85
    Publication Date: 2021-10-28
    Description: The millennial‐scale variability of the Atlantic Meridional Overturning Circulation (AMOC) is well documented for the last glacial termination and beyond. Despite its importance for the climate system, the evolution of the South Pacific overturning circulation (SPOC) is by far less well understood. A recently published study highlights the potential applicability of the 231Pa/230Th‐proxy in the Pacific. Here, we present five sedimentary down‐core profiles of 231Pa/230Th‐ratios measured on a depth transect from the Pacific sector of the Southern Ocean to test this hypothesis using downcore records. Our data are consistent with an increase in SPOC as early as 20 ka that peaked during Heinrich Stadial 1. The timing indicates that the SPOC did not simply react to AMOC changes via the bipolar seesaw but were triggered via Southern Hemisphere processes.
    Repository Name: EPIC Alfred Wegener Institut
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  • 86
    Publication Date: 2021-08-25
    Description: Three feeds; fish faeces recovered from a recirculating aquaculture system (RAS), fish faeces combined with watercress roots (Nasturtium officinale), and a commercial pelleted feed formulated for pike-perch, were fed to European Noble crayfish (Astacus astacus) (average initial body weight ± SD was10.7 g ± 3.5; average initial body length ± SD was 3.1 cm ± 0.4) for 84 days at excess daily rations. Crayfish fed with the pelleted fish feed exhibited significantly (P 〈 0.05) higher mean final body weight ± SD (FBW, 13.84 g ± 1.24) compared to animals fed fish faeces (11.14 g ± 0.47) and those fed the combination of fish faeces/watercress roots (12.91 g ± 1.99). Mean final body length (FBL) and survival were also significantly higher in animals fed pelleted fish feed than all other treatments (P 〈 0.05). Faecal macronutrient contents (28.5% crude protein and 2% lipid) are within required dietary range of A. astacus, indicating poor growth performance was not related to quantitative faecal macronutrient composition. The lysine and methionine content of faecal waste was 13.1 g kg⁻¹ and 3.8 g kg⁻¹ respectively. The methionine content of the faecal waste was therefore considerably below (60% below requirement) the requirement for crayfish. Amino acids known to stimulate feed intake in crayfish were about 50% lower in concentration in faeces compared to concentrations in pelleted fish feed. The concentration of taurine was below detection limit in faeces. It is hypothesized that unsuitable amino acid composition and/or limited ability to handle faeces explain low growth and survival rates in A. astacus fed fish faeces and the combination of fish faeces/watercress roots.
    Repository Name: EPIC Alfred Wegener Institut
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  • 87
    Publication Date: 2021-08-30
    Description: This study presents the first hydrogeochemical model of the hydrothermal systems of Turrialba and Irazú volcanoes in central Costa Rica, manifested as thermal springs, summit crater lakes, and fumarolic degassing at both volcanoes. Our period of observations (2007-2012) coincides with the pre- and early syn-phreatic eruption stages of Turrialba volcano that resumed volcanic unrest since 2004, after almost 140 years of quiescence. Peculiarly, the generally stable Irazú crater lake dropped its level during this reawakening of Turrialba. The isotopic composition of discharged fluids reveals their Caribbean meteoric origin. Four groups of thermal springs drain the northern flanks of Turrialba and Irazú volcanoes into two main rivers. Río Sucio (i.e. “dirty river”) is a major rock remover on the North flank of Irazú, mainly fed by the San Cayetano spring group. Instead, one group of thermal springs discharges towards the south of Irazú. All thermal spring waters are of SO4-type (i.e. steam heated waters), none of the springs has, however, a common hydrothermal end-member. A water mass budget for thermal springs results in an estimated total output flux of 187 ± 37 L/s, with 100 ± 20 L/s accounted for by the San Cayetano springs. Thermal energy release is estimated at 110 ± 22 MW (83.9 ± 16.8 MW by San Cayetano), whereas the total rock mass removal rate by chemical leaching is ~3,000 m3/y (~2,400 m3/y by San Cayetano-Río Sucio). Despite Irazú being the currently less active volcano, it is a highly efficient rock remover, which, on the long term can have effects on the stability of the volcanic edifice with potentially hazardous consequences (e.g. flank collapse, landslides, phreatic eruptions). Moreover, the vapor output flux from the Turrialba fumaroles after the onset of phreatic eruptions on 5 January 2010 showed an increase of at least ~260 L/s above pre-eruptive background fumarolic vapor fluxes. This extra vapor loss implies that the drying of the summit hydrothermal system of Turrialba could tap deeper than previously thought, and could explain the coincidental disappearance of Irazú’s crater lake in April 2010.
    Description: Published
    Description: 142
    Description: 2V. Struttura e sistema di alimentazione dei vulcani
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 88
    facet.materialart.
    Unknown
    American Geophysical Union
    In:  EPIC3Paleoceanography and Paleoclimatology, American Geophysical Union, 36(7), ISSN: 2572-4517
    Publication Date: 2021-09-20
    Description: Marine sedimentary records are a key archive when reconstructing past climate; however, mixing at the seabed (bioturbation) can strongly influence climate records, especially when sedimentation rates are low. By commingling the climate signal from different time periods, bioturbation both smooths climate records, by damping fast climate variations, and creates noise when measurements are made on samples containing small numbers of individual proxy carriers, such as foraminifera. Bioturbation also influences radiocarbon-based age-depth models, as sample ages may not represent the true ages of the sediment layers from which they were picked. While these effects were first described several decades ago, the advent of ultra-small-sample $^{14}$C dating now allows samples containing very small numbers of foraminifera to be measured, thus enabling us to directly measure the age-heterogeneity of sediment for the first time. Here, we use radiocarbon dates measured on replicated samples of 3-30 foraminifera to estimate age-heterogeneity for five marine sediment cores with sedimentation rates ranging from 2-30 cm kyr$^{-1}$. From their age-heterogeneities and sedimentation rates we infer mixing depths of 10-20 cm for our core sites. Our results show that when accounting for age-heterogeneity, the true error of radiocarbon dating can be several times larger than the reported measurement. We present estimates of this uncertainty as a function of sedimentation rate and the number of individuals per radiocarbon date. A better understanding of this uncertainty will help us to optimise radiocarbon measurements, construct age models with appropriate uncertainties and better interpret marine paleo records.
    Repository Name: EPIC Alfred Wegener Institut
    Type: Article , isiRev , info:eu-repo/semantics/article
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  • 89
    Publication Date: 2021-09-22
    Description: Many applications related to ground-motion studies and engineering seismology benefit from the opportunity to easily download large dataset of earthquake recordings with different magnitudes. In such applications, it is important to have a reliable seismic characterization of the stations to introduce appropriate correction factors for including site amplification. Generally, seismic networks in Europe describe the site properties of a station through geophysical or geological reports, but often ad-hoc field surveys are missing and the characterization is done using indirect proxy. It is then necessary to evaluate the quality of a seismic characterization, accounting for the available site information, the measurements procedure and the reliability of the applied methods to obtain the site parameters.In this paper, we propose a strategy to evaluate the quality of site characterization, to be included in the station metadata. The idea is that a station with a good site characterization should have a larger ranking with respect to one with poor or incomplete information. The proposed quality metric includes the computation of three indices, which take into account the reliability of the available site indicators, their number and importance, together with their consistency defined through scatter plots for each single pair of indicators. For this purpose, we consider the seven indicators identified as most relevant in a companion paper (Cultrera et al. 2021): fundamental resonance frequency, shear-wave velocity profile, time-averaged shear-wave velocity over the first 30 m, depth of both seismological and engineering bedrock, surface geology and soil class.
    Description: Published
    Description: 4643–4691
    Description: 5T. Sismologia, geofisica e geologia per l'ingegneria sismica
    Description: JCR Journal
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 90
    Publication Date: 2021-09-22
    Description: In recent years, the permanent seismic networks worldwide have largely increased, raising the amount of earthquake signals and the applications using seismic records. Although characterization of the soil properties at recording stations has a large impact on hazard estimates, it has not been implemented so far in a standardized way for reaching high-level metadata. To address this issue, we built an online questionnaire for the identification of the indicators useful for a reliable site characterization at a seismic station. We analysed the answers of a large number of experts in different fields, which allowed us to rank 24 different indicators and to identify the most relevant ones: fundamental frequency (f0), shear-wave velocity profile (VS), time-averaged Vs over 30 m (VS30), depth of seismological and engineering bedrock (Hseis_bed and Heng_bed), surface geology and soil class. Moreover, the questionnaire proposed two additional indices in terms of cost and difficulty to obtain a reliable value of each indicator, showing that the selection of the most relevant indicators results from a complex balance between physical relevancy, average cost and reliability. For each indicator we propose a summary report, provided as editable pdf, containing the background information of data acquisition and processing details, with the aim to homogenize site metadata information at European level and to define the quality of the site characterization (see companion paper Di Giulio et al. 2021). The selected indicators and the summary reports have been shared within European and worldwide scientific community and discussed in a dedicated international workshop. They represent a first attempt to reach a homogeneous set of high-level metadata for site characterization.
    Description: Published
    Description: 4171–4195
    Description: 5T. Sismologia, geofisica e geologia per l'ingegneria sismica
    Description: JCR Journal
    Keywords: Site effects ; Station metadata ; Seismic network ; Strong ground motion ; Site proxies ; Seismic network database
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 91
    Publication Date: 2021-09-06
    Description: Granular flows of angular rock fragments such as rock avalanches and dense pyroclastic flows are simulated numerically by means of the discrete element method. Since large-scale flows generate stresses that are larger than those generated by small-scale flows, the purpose of these simulations is to understand the effect that the stress level has on flow mobility. The results show that granular flows that slide en mass have a flow mobility that is not influenced by the stress level. On the contrary, the stress level governs flow mobility when granular flow dynamics is affected by clast agitation and collisions. This second case occurs on a relatively rougher subsurface where an increase of the stress level causes an increase of flow mobility. The results show also that as the stress level increases, the effect that an increase of flow volume has on flow mobility switches sign from causing a decrease of mobility at low stress level to causing an increase of mobility at high stress level. This latter volume effect corresponds to the famous Heim’s mobility increase with the increase of the volume of large rock avalanches detected so far only in the field and for this reason considered inexplicable without resorting to extraordinary mechanisms. Granular flow dynamics is described in terms of dimensionless scaling parameters in three different granular flow regimes. This paper illustrates for each regime the functional relationship of flow mobility with stress level, flow volume, grain size, channel width, and basal friction.
    Description: Published
    Description: 3085-3099
    Description: 5V. Processi eruttivi e post-eruttivi
    Description: JCR Journal
    Keywords: Pyroclastic Flows ; Rock Avalanches ; Stress Level ; Flow Volume ; Mobility ; mobility of pyroclastic flows and rock avalanches
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
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  • 92
    facet.materialart.
    Unknown
    International Union of Crystallography | 5 Abbey Square, Chester, Cheshire CH1 2HU, England
    Publication Date: 2021-09-29
    Description: The resolution function of a spectrometer based on a strongly bent single crystal (bending radius of 10 cm or less) is evaluated. It is shown that the resolution is controlled by two parameters: (i) the ratio of the lattice spacing of the chosen reflection to the crystal thickness and (ii) a single parameter comprising crystal thickness, its bending radius, distance to a detector, and anisotropic elastic constants of the chosen crystal. The results allow the optimization of the parameters of bent‐crystal spectrometers for the hard X‐ray free‐electron laser sources.
    Description: The resolution function of a bent‐crystal spectrometer for pulses of an X‐ray free‐electron laser is evaluated. Under appropriate conditions, the energy resolution reaches the ratio of the lattice spacing to the crystal thickness. image
    Keywords: 548 ; X‐ray free‐electron lasers ; X‐ray spectroscopy ; bent crystals ; diamond crystal optics ; femtosecond X‐ray diffraction
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  • 93
    Publication Date: 2021-09-29
    Description: To study and control the incoherent inelastic background in small‐angle neutron scattering, which makes a significant contribution to the detected scattering from hydrocarbon systems, the KWS‐2 small‐angle neutron scattering diffractometer operated by the Jülich Centre for Neutron Science (JCNS) at Heinz‐Maier Leibnitz Zentrum (MLZ), Garching, Germany, was equipped with a secondary single‐disc chopper that is placed in front of the sample stage. This makes it possible to record in time‐of‐flight mode the scattered neutrons in the high‐Q regime of the instrument (i.e. short incoming wavelengths and detection distances) and to discard the inelastic component from the measured data. Examples of measurements on different materials routinely used as standard samples, sample containers and solvents in the experiments at KWS‐2 are presented. When only the elastic region of the spectrum is used in the data‐reduction procedure, a decrease of up to two times in the incoherent background of the experimentally measured scattering cross section may be obtained. The proof of principle is demonstrated on a solution of bovine serum albumin in D2O.
    Description: A new chopper has been installed at the sample position in front of the sample stage at the KWS‐2 small‐angle neutron‐scattering diffractometer of the Jülich Centre for Neutron Science. The pulsed beam and the time‐of‐flight data acquisition enable the separation of elastic and inelastic scattering from hydrogenous samples.
    Keywords: 548 ; TOF‐SANS ; incoherent neutron scattering ; inelastic neutron scattering ; hydrocarbon systems
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  • 94
    Publication Date: 2021-09-29
    Description: Cubic rare‐earth sesquioxide crystals are strongly demanded host materials for high power lasers, but due to their high melting points investigations on their thermodynamics and the growth of large‐size crystals of high optical quality remain a challenge. Detailed thermal investigations of the ternary system Lu2O3–Sc2O3–Y2O3 revealing a large range of compositions with melting temperatures below 2200°C and a minimum of 2053°C for the composition (Sc0.45Y0.55)2O3 are presented. These reduced temperatures enable for the first time the growth of high optical quality mixed sesquioxide crystals with disordered structure by the conventional Czochralski method from iridium crucibles. An (Er0.07Sc0.50Y0.43)2O3 crystal is successfully grown and characterized with respect to its crystallographic properties as well as its composition, thermal conductivity and optical absorption in the 1 µm range.
    Description: The phase diagram of the ternary system Lu2O3–Sc2O3–Y2O3 is investigated and compositions with melting points below 2200°C are found. This allows for the first successful growth of the mixed cubic sesquioxide crystal (Er0.07Sc0.50Y0.43)2O3 by the Czochralski method from an iridium crucible. image
    Keywords: 548 ; crystal growth ; optical materials ; phase diagrams ; melting points ; rare earth sesquioxides
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  • 95
    Publication Date: 2021-11-18
    Description: The transfer of vast amounts of carbon from a deep oceanic reservoir to the atmosphere is considered to be a dominant driver of the deglacial rise in atmospheric CO2. Paleoceanographic reconstructions reveal evidence for the existence of CO2-rich waters in the mid to deep Southern Ocean. These water masses ventilate to the atmosphere south of the Polar Front, releasing CO2 prior to the formation and subduction of intermediate-waters. Changes in the amount of CO2 in the sea water directly affect the oceanic carbon chemistry system. Here we present B/Ca ratios, a proxy for delta carbonate ion concentrations Δ[CO32−], and stable isotopes (δ13C) from benthic foraminifera from a sediment core bathed in Antarctic Intermediate Water (AAIW), offshore New Zealand in the Southwest Pacific. We find two transient intervals of rising [CO32−] and δ13C that that are consistent with the release of CO2 via the Southern Ocean. These intervals coincide with the two pulses in rising atmospheric CO2at ~ 17.5–14.3 ka and 12.9–11.1 ka. Our results lend support for the release of sequestered CO2 from the deep ocean to surface and atmospheric reservoirs during the last deglaciation, although further work is required to pin down the detailed carbon transfer pathways.
    Repository Name: EPIC Alfred Wegener Institut
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  • 96
    Publication Date: 2021-12-23
    Description: Methane emissions from northern high latitude wetlands constitute a major uncertainty in the atmospheric methane (CH4) budget during the Holocene. To reconstruct northern wetland methane emissions, we used an empirical model based on syntheses of observations of peat initiation from more than 3600 radiocarbon-dated basal peat ages, plant-macrofossil-derived peatland type from more than 250 peat cores from sites across the northern high latitudes, and observed CH4 emissions averaged from modern-day wetland types in order to explore the effects of wetland expansion and changes in wetland type. Peatland basal ages and plant macrofossil records showed the widespread formation of fens in major northern wetland complexes before 8000 BP. After 8000 BP, new fen formation continued, but widespread peatland succession (to bogs) and permafrost aggradation also occurred. Reconstructed CH4 emissions from peatlands increased rapidly between 10,600 BP and 6900 BP due to fen formation and expansion, then stabilized after 5000 BP at 42 ± 25 Tg CH4 y-1, as high methane-emitting fens transitioned to lower methane-emitting bogs and permafrost peatlands. Permafrost formation in northern peatlands after 1000 BP decreased CH4 emissions by 20% to 34 ± 21 Tg y-1 by the present day. Warming temperatures, changes in peatland hydrology, and permafrost thaw will likely change the magnitude of northern peatland emissions in the future.
    Repository Name: EPIC Alfred Wegener Institut
    Type: Conference , notRev , info:eu-repo/semantics/conferenceObject
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  • 97
    Publication Date: 2021-12-26
    Description: Infrastructure and anthropogenic impacts are expanding across the Arctic. A consistent record of human impact is required in order to quantify the changes and to assess climate change impacts on the communities. We derived a first panarctic satellite-based record of expanding infrastructure and anthropogenic impacts along all permafrost affected coasts (100 km buffer) within the H2020 project Nunataryuk based on Sentinel-1/2 satellite imagery. C-band synthetic aperture radar and multi-spectral information is combined through a machine learning framework. Depending on region, we identified up to 50% more information (human presence) than in OpenStreetMap. The combination with satellite records on vegetation change (specifically NDVI from Landsat since 2000) allowed quantification of recent expansion of infrastructure. Most of the expanded human presence occurred in Russia related predominantly to oil/gas industry. The majority of areas with human presence will be subject to thaw by mid-21st century based on ground temperature trends derived from the ESA CCI+ Permafrost time series (1997-2019). Of specific concern in this context are also settlements located directly at permafrost affected coasts. An efficient erosion rate monitoring scheme needs to be developed and combined with settlement records in order to assess the risk for local communities and infrastructure. Relevant progress in the framework of the ESA EO4PAC project will be discussed.
    Repository Name: EPIC Alfred Wegener Institut
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  • 98
    facet.materialart.
    Unknown
    American Geophysical Union
    In:  EPIC3AGU Fall Meeting 2021, Online, 2021-12-13-2021-12-17American Geophysical Union
    Publication Date: 2021-12-26
    Description: Retrogressive thaw slumps (RTS) are typical landforms indicating processes of rapid thawing and degrading permafrost. Their abundance is increasing in many regions and quantifying their dynamics is of high importance for assessing geomorphic, hydrologic, and biogeochemical impacts of climate change in the Arctic. Here we present a deep-learning (DL) based semantic segmentation framework to detect RTS, using high-resolution multi-spectral PlanetScope, topographic (ArcticDEM elevation and slope), and medium-resolution multi-temporal Landsat Trend data. We created a highly automated processing pipeline, which is designed to allow reproducible results and to be flexible for multiple input data types. The processing workflow is based on the pytorch deep-learning framework and includes a variety of different segmentation architectures (UNet, UNet++, DeepLabV3), backbones and includes common data transformation techniques such as augmentation or normalization. We tested (training, validation) our DL based model in six different regions of 100 to 300 km² size across Canada, and Siberia. We performed a regional cross-validation (5 regions training, 1 region validation) to test the spatial robustness and transferability of the algorithm. Furthermore, we tested different architectures, backbones and loss-functions to identify the best performing and most robust parameter sets. For training the models we created a database of manually digitized and validated RTS polygons. The resulting model performance varied strongly between different regions with maximum Intersection over Union (IoU) scores between 0.15 and 0.58. The strong regional variation emphasizes the need for sufficiently large training data, which is representative of the diversity of RTS types. However, the creation of good training data proved to be challenging due to the fuzzy definition and delineation of RTS. We are further continuing to improve the usability and the functionality to add further datasets and classes. We will show first results from the upscaling beyond small test areas towards large spatial clusters of extensive RTS presence e.g. Peel Plateau in NW Canada.
    Repository Name: EPIC Alfred Wegener Institut
    Type: Conference , notRev
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  • 99
    Publication Date: 2021-12-26
    Description: With the Earth’s climate rapidly warming, the Arctic represents one of the most vulnerable regions to environmental change. These northern high latitude regions experience intensified fire seasons and especially tundra fires are projected to become more frequent and severe. Fires in permafrost regions have extensive impacts, including the initiation of thermokarst (rapid thaw of ice-rich ground), as they combust the upper organic soil layers which provide insulation to the permafrost below. Rapid permafrost thaw is, thus, often observable in fire scars in the first years post-disturbance. In polygonal ice-wedge landscapes, this becomes most prevalent through melting ice wedges and degrading troughs. The further these ice wedges degrade, the more troughs will likely connect and build an extensive hydrological network with changing patterns and degrees of connectivity that influences hydrology and runoff. While subsiding troughs over melting ice wedges may host new ponds, an increasing connectivity may also subsequently lead to more drainage of ponds, which in turn can limit further thaw and help stabilize the landscape. To quantify the changes in such dynamic landscapes over large regions, highly automated methods are needed that allow extracting information on the geomorphic state and changes over time of ice-wedge trough networks from remote sensing data. We developed a computer vision algorithm to automatically derive ice-wedge polygonal networks and the current microtopography of the degrading troughs from very high resolution, airborne laserscanning-based digital terrain models. We represent the networks as graphs (a concept from the computer sciences to describe complex networks) and apply methods from graph theory to describe and quantify hydrological network characteristics of the changing landscape. In fire scars, we especially observe rapidly growing networks and fast micromorphological change in those degrading troughs. In our study, we provide a space-for-time substitution comparing fire scars throughout the Alaskan tundra of up to 70 years since the fire disturbance, to show how this type of disturbed landscape evolves over time.
    Repository Name: EPIC Alfred Wegener Institut
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  • 100
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    American Geophysical Union
    In:  EPIC3AGU Fall Meeting 2021, Online, 2021-12-13-2021-12-17American Geophysical Union
    Publication Date: 2021-12-26
    Description: Using our custom visualization tool for multitemporal Landsat satellite imagery we discovered, to our knowledge, an undocumented mega-landslide in far-east Siberia, which occurred in summer 2017 (https://bit.ly/2WYRLM1; 61.55°N; 170.01°E). To create and visualize this unique dataset, we processed temporal trends of multispectral indices of 〉100,000 Landsat images for a period from 2000-2019 using the freely available Google Earth Engine cloud processing platform (https://ingmarnitze.users.earthengine.app/view/hotspottcvisapp). The megaslide has a size of 3.66 km² and using the ArcticDEM data we estimate a volume movement of ~20 Mm³. With this size and volume, the landslide is among the largest globally known in recent decades. The landslide is accompanied by a smaller one (0.31 km², 1 Mm³) about 600 m further east, which already occurred in summer 2015. The large landslide caused the formation of several small lakes by blocking two valleys with debris and within newly formed crevasses near the hilltop, which are still persisting as of August 2021. As this event occurred in a remote valley far from any settlement, no visible damage to infrastructure or human livelihoods was detected. The remoteness has likely led to being not detected, like many similar, albeit a lot smaller, erosion features in the Arctic permafrost region. In this presentation we will show the main properties of the landslide, potential trigger mechanisms in the traditional sense. As this region is located along the fringes of permafrost presence we will discuss its potential connection to the rapidly warming climate in the high latitudes. Further, we will discuss how such a large event remained undetected for several years. We discuss and highlight the value of our landscape change visualization tool based on Landsat trend analysis (see Nitze et al., AGU 2020), which helped us to identify this extreme event. With more and more available data sources, this tool in addition to automated image analysis (e.g. deep-learning) or seismic analysis will help to uncover the hidden processes and dynamics of the Earth’s surface.
    Repository Name: EPIC Alfred Wegener Institut
    Type: Conference , notRev
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