Ideas of quantum chemistry. Volume 2, Interactions /
"Ideas of Quantum Chemistry, Volume Two: Interactions highlights the motions and systems in quantum chemistry and the models and tools used to assess them, thus giving detailed insights into the behaviors underlying quantum chemistry. Using an innovative structure to show the logical relationsh...
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| Language: | English |
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Amsterdam, Netherlands :
Elsevier,
[2020]
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| Edition: | Third edition. |
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| Online Access: | ScienceDirect |
Table of Contents:
- Introduction
- Electronic orbital interactions in periodic systems
- Correlation and anticorrelation of electronic motions
- Chasing the correlation dragon: density functional theory (DFT)
- The molecule subject to electric or magnetic fields
- Intermolecular interactions
- Chemical reactions
- Information processing: the mission of chemistry
- Appendices. Dirac notation for integrals. Hartree-Fock (or molecular orbitals) method
- Second quantization
- Population analysis
- Pauli deformation
- Hydrogen atom in electric field: variational approach
- Multipole expansion
- NMR shielding and coupling constants: derivation
- Acceptor-donor structure contributions in the MO configuration
- Acronyms and their explanation.