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  • 1
    Monograph available for loan
    Monograph available for loan
    Natural zeolites : occurrence, properties, applications (2001)
    Washington, D.C. : Mineralogical Society of America
    Associated volumes
    Details Availability
    Call number: M 02.0026 / Regal 11
    In: Reviews in mineralogy & geochemistry
    Description / Table of Contents: Mineralogy and Geology of Natural Zeolites was published in 1977. Dr. Fred Mumpton, a leader of the natural zeolite community for more than three decades, edited the original volume. Since the time of the original MSA zeolite short course in November 1977, there have been major developments concerning almost all aspects of natural zeolites. There has been an explosion in our knowledge of the crystal chemistry and structures of natural zeolites (Chapters 1 and 2), due in part to the now-common Rietveld method that allows treatment of powder diffraction data. Studies on the geochemistry of natural zeolites have also greatly increased, partly as a result of the interests related to the disposal of radioactive wastes, and Chapters 3, 4, 5, 13, and 14 detail the latest results in this important area. Until the latter part of the 20th century, zeolites were often looked upon as a geological curiosity, but they are now known to be widespread throughout the world in sedimentary and igneous deposits and in soils (Chapters 6-12). Likewise, borrowing from new knowledge gained from studies of synthetic zeolites and properties of natural zeolites, the application of natural zeolites has greatly expanded since the first zeolite volume. Chapter 15 details the use of natural zeolites for removal of ammonium ions, heavy metals, radioactive cations, and organic molecules from natural waters, wastewaters, and soils. Similarly, Chapter 16 describes the use of natural zeolites as building blocks and cements in the building industry, Chapter 17 outlines their use in solar energy storage, heating, and cooling applications, and Chapter 18 describes their use in a variety of agricultural applications, including as soil conditioners, slow-release fertilizers, soil-less substrates, carriers for insecticides and pesticides, and remediation agents in contaminated soils. Most of the material in this volume is entirely new, and Natural Zeolites: Occurrence, Properties, Applications presents a fresh and expanded look at many of the subjects contained in Volume 4. It is our hope that this new, expanded volume will rekindle interest in this fascinating and technologically important group of minerals, in part through the 'Suggestions for Further Research' section in each chapter.
    Type of Medium: Monograph available for loan
    Pages: XIV, 654 S.
    ISBN: 0-939950-57-X , 978-0-939950-57-7
    ISSN: 1529-6466
    Series Statement: Reviews in mineralogy & geochemistry 45
    URL: http://rimg.geoscienceworld.org/content/45/1
    Classification:
    Mineralogy
    Language: English
    Note: MINERALOGY Chapter 1. Crystal Structures of Natural Zeolites by Thomas Armbruster and Mickey E. Gunter, p. 1 - 68 Chapter 2. The Crystal Chemistry of Zeolites by E Passaglia and Richard A. Sheppard, p. 69 - 116 Chapter 3. Geochemical Stability of Natural Zeolites by Steve J. Chipera and John A. Apps, p. 117 - 162 Chapter 4. Isotope Geochemistry of Zeolites by Haraldur R. Karlsson, p. 163 - 206 Chapter 5. Clinoptilolite-Heulandite Nomenclature by David L. Bish and Jeremy M. Boak, p. 207 - 216 OCCURRENCE Chapter 6. Occurrence of Zeolites in Sedimentary Rocks: An Overview by Richard L. Hay and Richard A. Sheppard, p. 217 - 234 Chapter 7. Zeolites in Closed Hydrologic Systems by A Langella, Piergiulio Cappelletti, and Roberto de'Gennaro, p. 235 - 260 Chapter 8. Formation of Zeolites in Open Hydrologic Systems by Richard A. Sheppard and Richard L. Hay, p. 261 - 276 Chapter 9. Zeolites in Burial Diagenesis and Low-grade Metamorphic Rocks by Minora Utada, p. 277 - 304 Chapter 10. Zeolites in Hydrothermally Altered Rocks by Minora Utada, p. 305 - 322 Chapter 11. Zeolites in Soil Environments by Douglas W. Ming and Janis L. Boettinger, p. 323 - 346 Chapter 12. Zeolites in Petroleum and Natural Gas Reservoirs by Azuma Iijima, p. 347 - 402 PHYSICOCHEMICAL PROPERTIES Chapter 13. Thermal Behavior of Natural Zeolites by David L. Bish and J. William Carey, p. 403 - 452 Chapter 14. Cation-Exchange Properties of Natural Zeolites by Roberto T. Pabalan and F. Paul Bertetti, p. 453 - 518 APPLICATIONS Chapter 15. Applications of Natural Zeolites in Water and Wastewater Treatment by Dénes Kalló, p. 519 - 550 Chapter 16. Use of Zeolitic Tuff in the Building Industry by Carmine Colella, Maurizio de'Gennaro, and Rosario Aiello, p. 551 - 588 Chapter 17. Natural Zeolites in Solar Energy - Heating, Cooling, and Energy Storage by Dimiter I. Tchernev, p. 589 - 618 Chapter 18. Use of Natural Zeolites in Agronomy, Horticulture, and Environmental Soil Remediation by Douglas W. Ming and Earl R. Allen, p. 619 - 654
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  • 2
    Monograph available for loan
    Monograph available for loan
    Molecular modeling theory : applications in the geosciences (2001)
    Washington, D.C. : Mineralogical Soc. of America
    Associated volumes
    Details Availability
    Call number: 11/M 01.0313
    In: Reviews in mineralogy & geochemistry
    Description / Table of Contents: The review chapters in this volume were the basis for a short course on molecular modeling theory jointly sponsored by the Geochemical Society (GS) and the Mineralogical Society of America (MSA) May 18-20, 2001 in Roanoke, Virginia which was held prior to the 2001 Goldschmidt Conference in nearby Hot Springs, Virginia. Dr. William C. Luth has had a long and distinguished career in research, education and in the government. He was a leader in experimental petrology and in training graduate students at Stanford University. His efforts at Sandia National Laboratory and at the Department of Energy's headquarters resulted in the initiation and long-term support of many of the cutting edge research projects whose results form the foundations of these short courses. Bill's broad interest in understanding fundamental geochemical processes and their applications to national problems is a continuous thread through both his university and government career. He retired in 1996, but his efforts to foster excellent basic research, and to promote the development of advanced analytical capabilities gave a unique focus to the basic research portfolio in Geosciences at the Department of Energy. He has been, and continues to be, a friend and mentor to many of us. It is appropriate to celebrate his career in education and government service with this series of courses in cutting-edge geochemistry that have particular focus on Department of Energy-related science, at a time when he can still enjoy the recognition of his contributions. Molecular modeling methods have become important tools in many areas of geochemical and mineralogical research. Theoretical methods describing atomistic and molecular-based processes are now commonplace in the geosciences literature and have helped in the interpretation of numerous experimental, spectroscopic, and field observations. Dramatic increases in computer power-involving personal computers, workstations, and massively parallel supercomputers-have helped to increase our knowledge of the fundamental processes in geochemistry and mineralogy. All researchers can now have access to the basic computer hardware and molecular modeling codes needed to evaluate these processes. The purpose of this volume of Reviews in Mineralogy and Geochemistry is to provide the student and professional with a general introduction to molecular modeling methods and a review of various applications of the theory to problems in the geosciences. Molecular mechanics methods that are reviewed include energy minimization, lattice dynamics, Monte Carlo methods, and molecular dynamics. Important concepts of quantum mechanics and electronic structure calculations, including both molecular orbital and density functional theories, are also presented. Applications cover a broad range of mineralogy and geochemistry topics-from atmospheric reactions to fluid-rock interactions to properties of mantle and core phases. Emphasis is placed on the comparison of molecular simulations with experimental data and the synergy that can be generated by using both approaches in tandem. We hope the content of this review volume will help the interested reader to quickly develop an appreciation for the fundamental theories behind the molecular modeling tools and to become aware of the limits in applying these state-of-the-art methods to solve geosciences problems.
    Type of Medium: Monograph available for loan
    Pages: xii, 531 S.
    ISBN: 0-939950-54-5 , 978-0-939950-54-6
    ISSN: 1529-6466
    Series Statement: Reviews in mineralogy & geochemistry 42
    URL: http://rimg.geoscienceworld.org/content/42/1
    Classification:
    Mineralogy
    Language: English
    Note: Chapter 1. Molecular Modeling in Mineralogy and Geochemistry by Randall T. Cygan, p. 1 - 36 Chapter 2. Simulating the Crystal Structures and Properties of Ionic Materials From Interatomic Potentials by Julian D. Gale, p. 37 - 62 Chapter 3. Application of Lattice Dynamics and Molecular Dynamics Techniques to Minerals and Their Surfaces by Steve C. Parker, Nora H. de Leeuw, Ekatarina Bourova, and David J. Cooke, p. 63 - 82 Chapter 4. Molecular Simulations of Liquid and Supercritical Water: Thermodynamics, Structure, and Hydrogen Bonding by Andrey G. Kalinichev, p. 83 - 130 Chapter 5. Molecular Dynamics Simulations of Silicate Glasses and Glass Surfaces by Stephen H. Garofalini, p. 131 - 168 Chapter 6. Molecular Models of Surface Relaxation, Hydroxylation, and Surface Charging at Oxide-Water Interfaces by James R. Rustad, p. 169 - 198 Chapter 7. Structure and Reactivity of Semiconducting Mineral Surfaces: Convergence of Molecular Modeling and Experiment by Kevin M. Rosso, p. 199 - 272 Chapter 8. Quantum Chemistry and Classical Simulations of Metal Complexes in Aqueous Solutions by David M. Sherman, p. 273 - 318 Chapter 9. First Principles Theory of Mantle and Core Phases by Lars Stixrude, p. 319 - 344 Chapter 10. A Computational Quantum Chemical Study of the Bonded Interactions in Earth Materials and Structurally and Chemically Related Molecules by G. V. Gibbs, Monte B. Boisen, Jr., Lesa L. Beverly, and Kevin M. Rosso, p. 345 - 382 Chapter 11. Modeling the Kinetics and Mechanisms of Petroleum and Natural Gas Generation: A First Principles Approach by Yitian Xiao, p. 383 - 436 Chapter 12. Calculating the NMR Properties of Minerals, Glasses, and Aqueous Species by John D. Tossell, p. 437 - 458 Chapter 13. Interpretation of Vibrational Spectra Using Molecular Orbital Theory Calculations by James D. Kubicki, p. 459 - 484 Chapter 14. Molecular Orbital Modeling and Transition State Theory in Geochemistry by Mihali A. Felipe, Yitian Xiao, and James D. Kubicki, p. 485 - 531
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