Theoretical and Computational Methods in Mineral Physics Geophysical Applications.

Reviews in Mineralogy & Geochemistry (RiMG) volumes contain concise advances in theoretical and/or applied mineralogy, crystallography, petrology, and geochemistry.

Bibliographic Details
Main Author: Wentzcovitch, Renata M.
Other Authors: Stixrude, Lars
Format: eBook
Language:English
Published: Boston De Gruyter, Inc., 2018.
Series:Reviews in Mineralogy and Geochemistry Ser.
Subjects:
Online Access:https://www.lib.tsu.ru/mminfo/2023/EBSCO/1939305.pdf
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245 1 0 |a Theoretical and Computational Methods in Mineral Physics  |b Geophysical Applications. 
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300 |a 1 online resource (504 pages) 
490 1 |a Reviews in Mineralogy and Geochemistry Ser. ;  |v v. 71 
588 0 |a Print version record. 
505 0 |a Intro; SHORT COURSE SERIES DEDICATION; PREFACE; TABLE OF CONTENTS; 1. Density Functional Theory of Electronic Structure: A Short Course for Mineralogists and Geophysicists; 2. The Minnesota Density Functionals and their Applications to Problems in Mineralogy and Geochemistry; 3. Density-Functional Perturbation Theory for Quasi-Harmonic Calculations; 4. Thermodynamic Properties and Phase Relations in Mantle Minerals Investigated by First Principles Quasiharmonic Theory; 5. First Principles Quasiharmonic Thermoelasticity of Mantle Minerals; 6. An Overview of Quantum Monte Carlo Methods 
505 8 |a 7. Quantum Monte Carlo Studies of Transition Metal Oxides8. Accurate and Efficient Calculations on Strongly Correlated Minerals with the LDA+U Method: Review and Perspectives; 9. Spin-State Crossover of Iron in Lower-Mantle Minerals: Results of DFT+U Investigations; 10. Simulating Diffusion; 11. Modeling Dislocations and Plasticity of Deep Earth Materials; 12. Theoretical Methods for Calculating the Lattice Thermal Conductivity of Minerals; 13. Evolutionary Crystal Structure Prediction as a Method for the Discovery of Minerals and Materials; 14. Multi-Mbar Phase Transitions in Minerals 
505 8 |a 15. Computer Simulations on Phase Transitions in Ice16. Iron at Earth's Core Conditions from First Principles Calculations; 17. First-Principles Molecular Dynamics Simulations of Silicate Melts: Structural and Dynamical Properties; 18. Lattice Dynamics from Force-Fields as a Technique for Mineral Physics; 19. An Efficient Cluster Expansion Method for Binary Solid Solutions: Application to the Halite-Silvite, NaCl-KCl, System; 20. Large Scale Simulations; 21. Thermodynamics of the Earth's Mantle 
520 |a Reviews in Mineralogy & Geochemistry (RiMG) volumes contain concise advances in theoretical and/or applied mineralogy, crystallography, petrology, and geochemistry. 
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653 4 |a Mineralchemie. 
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700 1 |a Stixrude, Lars. 
776 0 8 |i Print version:  |a Wentzcovitch, Renata M.  |t Theoretical and Computational Methods in Mineral Physics : Geophysical Applications.  |d Boston : De Gruyter, Inc., ©2018  |z 9780939950850 
830 0 |a Reviews in Mineralogy and Geochemistry Ser. 
856 4 0 |u https://www.lib.tsu.ru/mminfo/2023/EBSCO/1939305.pdf 
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