| 书目名称 | Quantum Geochemistry | | 编辑 | Giulio Armando Ottonello | | 视频video | | | 概述 | Summarizes fundamental thermodynamic principles.Presents many applications for earth scientists.Contains a comprehensive appendix with equations and functions | | 丛书名称 | Springer Geochemistry | | 图书封面 |  | | 描述 | .This book summarizes recent impressive improvements in the application of Quantum Mechanics, coupled with the significant increase in both speed and storage capabilities of modern computers, that allow to depict the energy and reactive properties of chemically complex materials through first principles and destroy the dogmatic assumption that the natural complexity cannot be modeled. It presents methods of Quantum Chemistry applied to various fields of geoscience. The book aims to convey to the audience, methods and procedures apt to obtain sound thermodynamic and thermo-physical data for earth’s materials under various aggregation states. The attention of this book focusses on the applicative aspects of the various procedures, with reference to the underlying theory.. | | 出版日期 | Book 2024 | | 关键词 | Schrödinger equation; Quantum Mechanical Hamiltonian; Harmonic oscillator; Gaussian basis sets; Lattice | | 版次 | 1 | | doi | https://doi.org/10.1007/978-3-031-21837-8 | | isbn_softcover | 978-3-031-21839-2 | | isbn_ebook | 978-3-031-21837-8Series ISSN 2366-6285 Series E-ISSN 2366-6293 | | issn_series | 2366-6285 | | copyright | Springer Nature Switzerland AG 2024 |
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发表于 2025-3-21 16:24:23
