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  • Geochronology  (1)
  • Polyethylene, energy band structures and electron distribution of ∼  (1)
  • 1
    Digitale Medien
    Digitale Medien
    Springer
    Theoretical chemistry accounts 50 (1978), S. 193-209 
    ISSN: 1432-2234
    Schlagwort(e): Polyethylene, energy band structures and electron distribution of ∼
    Quelle: Springer Online Journal Archives 1860-2000
    Thema: Chemie und Pharmazie
    Notizen: Abstract The electronic structure of polyethylene has been re-examined using Gaussian basis sets in anab initio solid-state method. Previous calculations were shown to possess a minor error in unit-cell coordinates and were corrected. Six basis sets were used and the results compared within the nearest-neighbour approximation. The effect on the calculation of increasing the number of interacting unit cells to five was studied. The latter produces no significant change in the C-H polarity; the overall conduction band width remains essentially the same but the Koopmans' ionization potential is displaced more towards the experimental value. An investigation was made into the effects of neighbouring strands on a central filament. We find that the Point Charge Perturbation model is a useful one in this context and yields a realistic interstrand distance. This is dominated by the hydrogen atoms. It is essentially unaffected by extension of the perturbing field to second neighbour strands.
    Materialart: Digitale Medien
    Standort Signatur Erwartet Verfügbarkeit
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  • 2
    Publikationsdatum: 2022-05-25
    Beschreibung: Author Posting. © American Geophysical Union, 2013. This article is posted here by permission of American Geophysical Union for personal use, not for redistribution. The definitive version was published in Geochemistry, Geophysics, Geosystems 14 (2013); 2084–2099, doi:10.1002/ggge.20133.
    Beschreibung: Forty-nine hydrothermal sulfide-sulfate rock samples from the Endeavour Segment of the Juan de Fuca Ridge, northeastern Pacific Ocean, were dated by measuring the decay of 226Ra (half-life of 1600 years) in hydrothermal barite to provide a history of hydrothermal venting at the site over the past 6000 years. This dating method is effective for samples ranging in age from ∼200 to 20,000 years old and effectively bridges an age gap between shorter- and longer-lived U-series dating techniques for hydrothermal deposits. Results show that hydrothermal venting at the active High Rise, Sasquatch, and Main Endeavour fields began at least 850, 1450, and 2300 years ago, respectively. Barite ages of other inactive deposits on the axial valley floor are between ∼1200 and ∼2200 years old, indicating past widespread hydrothermal venting outside of the currently active vent fields. Samples from the half-graben on the eastern slope of the axial valley range in age from ∼1700 to ∼2925 years, and a single sample from outside the axial valley, near the westernmost valley fault scarp is ∼5850 ± 205 years old. The spatial relationship between hydrothermal venting and normal faulting suggests a temporal relationship, with progressive younging of sulfide deposits from the edges of the axial valley toward the center of the rift. These relationships are consistent with the inward migration of normal faulting toward the center of the valley over time and a minimum age of onset of hydrothermal activity in this region of 5850 years.
    Beschreibung: This work was supported by a NSERC PGS scholarship and SEG Canada Foundation Student Research grant to J. W. Jamieson, NSERC Discovery grant to M. D. Hannington, NSF Ocean Sciences grant OCE-0732661 to J. F. Holden, and NSF grant OCE-1038135 to M. K. Tivey. D. A. Clague and the MBARI cruise were supported by a grant to MBARI from the David and Lucile Packard Foundation.
    Beschreibung: 2014-01-08
    Schlagwort(e): Hydrothermal ; Sulphide ; Geochronology ; Endeavour
    Repository-Name: Woods Hole Open Access Server
    Materialart: Article
    Format: application/pdf
    Standort Signatur Erwartet Verfügbarkeit
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