Titlebook: Topological Approaches to the Chemical Bond; ángel Martín Pendás,Julia Contreras-García Textbook 2023 The Editor(s) (if applicable) and Th

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Electron Pairing Descriptorst scalars in real space that sense these different behaviors. We pay especial attention to the electron localization function?(ELF), which has been widely used in the literature. Several interpretations of ELF?are put forward, and its relation to Gillespie’s?valence shell electron pair repulsion (VSEPR) model examined.

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Textbook 2023ed from the available textbooks. The book is accompanied by worked examples, exercises and solutions and is a great tool for any quantum chemistry or computational chemistry course at the graduate and advanced undergraduate levels..

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2214-4714 duate 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 availab

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Topological Spaces,will be introduced are well known from introductory courses in Mathematical Analysis (i.e. critical points of many-variables functions and their characterization by means of the Hessian matrix), while others (i.e. the axiomatic definition of a topological space) will be probably less familiar to the

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