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Topological approaches to the chemic...

Contreras-Garcia, Julia.

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Topological approaches to the chemical bond

Record Type:	Electronic resources : Monograph/item
Title/Author:	Topological approaches to the chemical bond/ by Angel Martin Pendas, Julia Contreras-García.
Author:	Pendas, Angel Martín.
other author:	Contreras-Garcia, Julia.
Published:	Cham :Springer International Publishing : : 2023.,
Description:	xxii, 407 p. :ill., digital ;24 cm.
[NT 15003449]:	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.
Contained By:	Springer Nature eBook
Subject:	Quantum chemistry. -
Online resource:	https://doi.org/10.1007/978-3-031-13666-5
ISBN:	9783031136665

Topological approaches to the chemical bond
Pendas, Angel Martín.

Topological approaches to the chemical bond[electronic resource] /by Angel Martin Pendas, Julia Contreras-García. - Cham :Springer International Publishing :2023. - xxii, 407 p. :ill., digital ;24 cm. - Theoretical chemistry and computational modelling,2214-4722. - Theoretical chemistry and computational modelling..

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.

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 available topological tools, their use and spectrum of applications and provides graduate students and researchers with information not easily obtained 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.

ISBN: 9783031136665

Standard No.: 10.1007/978-3-031-13666-5doiSubjects--Topical Terms:

519235
Quantum chemistry.

LC Class. No.: QD462 / .P45 2023

Dewey Class. No.: 541.28

Topological approaches to the chemical bond
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100 1 $a Pendas, Angel Martín. $3 3627985
245 1 0 $a Topological approaches to the chemical bond $h [electronic resource] / $c by Angel Martin Pendas, Julia Contreras-García.
260 $a Cham : $b Springer International Publishing : $b Imprint: Springer, $c 2023.
300 $a xxii, 407 p. : $b ill., digital ; $c 24 cm.
490 1 $a Theoretical chemistry and computational modelling, $x 2214-4722
505 0 $a 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.
520 $a 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 available topological tools, their use and spectrum of applications and provides graduate students and researchers with information not easily obtained 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.
650 0 $a Quantum chemistry. $3 519235
650 0 $a Chemical bonds. $3 560512
650 1 4 $a Theoretical Chemistry. $3 3591855
650 2 4 $a Applications of Mathematics. $3 890893
650 2 4 $a Mathematical Applications in Chemistry. $3 3596663
650 2 4 $a Physical Chemistry. $3 890828
700 1 $a Contreras-Garcia, Julia. $3 3627986
710 2 $a SpringerLink (Online service) $3 836513
773 0 $t Springer Nature eBook
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856 4 0 $u https://doi.org/10.1007/978-3-031-13666-5
950 $a Chemistry and Materials Science (SpringerNature-11644)