Topological Approaches to the Chemical Bond
This graduate textbook provides comprehensive information on topological analysis in real space of the electronic structure. Application of the topological tools is becoming routine for understanding the outcome of quantum chemical calculations. This title thoroughly reviews a selection of currently...
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| Main Authors: | , |
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| Institution som forfatter: | |
| Format: | Electronisk eBog |
| Sprog: | engelsk |
| Udgivet: |
Cham :
Springer International Publishing : Imprint: Springer,
2023.
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| Udgivelse: | 1st ed. 2023. |
| Serier: | Theoretical Chemistry and Computational Modelling,
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| Fag: | |
| Online adgang: | https://doi.org/10.1007/978-3-031-13666-5 |
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Indholdsfortegnelse:
- Introduction
- Topological spaces
- Part I Descriptors
- The electron density
- Electron pairing descriptors
- Weak interactions
- Part II Applications
- Molecules
- Solid state
- Part III Exercises
- Algorithms & software
- Exercises
- Solutions.