Density Functional Theory in Chemistry

作者： Robert G. Parr

DOI: 10.1007/978-1-4757-0818-9_5

关键词: Theoretical physics 、 Energy functional 、 Chemistry (relationship) 、 Work (thermodynamics) 、 Computation 、 Density functional theory 、 Exact theory

摘要: In these lectures I will summarize some of the things that we have been doing in my laboratory with density functional theory. 1–63 Concepts are emphasized rather than …

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参考文章(78)

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