Titre :	Mathematical physics in theoretical chemistry
Type de document :	texte imprimé
Auteurs :	House, James E., Éditeur scientifique ; Blinder, S. M., Éditeur scientifique
Editeur :	Amsterdam : Elsevier Science
Année de publication :	2019
Importance :	xv, 408 p.
ISBN/ISSN/EAN :	978-0-12-813651-5
Langues :	Anglais (eng)
Catégories :	Chimie théorique
Tags :	CHEMISTRY-PHYSICAL AND THEORETICAL  CHEMISTRY-MATHEMATICS
Index. décimale :	B-H
Résumé :	Mathematical Physics in Theoretical Chemistry deals with important topics in theoretical and computational chemistry. Topics covered include density functional theory, computational methods in biological chemistry, and Hartree-Fock methods. As the second volume in the Developments in Physical & Theoretical Chemistry series, this volume further highlights the major advances and developments in research, also serving as a basis for advanced study. With a multidisciplinary and encompassing structure guided by a highly experienced editor, the series is designed to enable researchers in both academia and industry stay abreast of developments in physical and theoretical chemistry.
Note de contenu :	"* The Hartree-Fock Approximation * Slater and Gaussian Basis Functions and Computation of Molecular Integrals * Post Hartree-Fock Methods: Configuration Interaction, Many-Body Perturbation Theory, Couple-Cluster Theory * Density-Functional Methods * Vibrational Energies and Partition Functions * Quantum Monte-Carlo * Computational Chemistry on Personal Computers * Chemical Applications of Graph Theory * Singularity Analysis in Quantum Chemistry * Diagrammatic Methods in Quantum Chemistry * Quantum Chemistry on a Quantum Computer
Cote :	B-H079
Num_Inv :	3556
Localisation :	LCC (SdS)

Mathematical physics in theoretical chemistry [texte imprimé] / House, James E., Éditeur scientifique ; Blinder, S. M., Éditeur scientifique . - Amsterdam : Elsevier Science, 2019 . - xv, 408 p.
ISBN : 978-0-12-813651-5
Langues : Anglais (eng)

Catégories :	Chimie théorique
Tags :	CHEMISTRY-PHYSICAL AND THEORETICAL  CHEMISTRY-MATHEMATICS
Index. décimale :	B-H
Résumé :	Mathematical Physics in Theoretical Chemistry deals with important topics in theoretical and computational chemistry. Topics covered include density functional theory, computational methods in biological chemistry, and Hartree-Fock methods. As the second volume in the Developments in Physical & Theoretical Chemistry series, this volume further highlights the major advances and developments in research, also serving as a basis for advanced study. With a multidisciplinary and encompassing structure guided by a highly experienced editor, the series is designed to enable researchers in both academia and industry stay abreast of developments in physical and theoretical chemistry.
Note de contenu :	"* The Hartree-Fock Approximation * Slater and Gaussian Basis Functions and Computation of Molecular Integrals * Post Hartree-Fock Methods: Configuration Interaction, Many-Body Perturbation Theory, Couple-Cluster Theory * Density-Functional Methods * Vibrational Energies and Partition Functions * Quantum Monte-Carlo * Computational Chemistry on Personal Computers * Chemical Applications of Graph Theory * Singularity Analysis in Quantum Chemistry * Diagrammatic Methods in Quantum Chemistry * Quantum Chemistry on a Quantum Computer
Cote :	B-H079
Num_Inv :	3556
Localisation :	LCC (SdS)