Applications of density functional theory to chemical reactivity

Applications of density functional theory to ...
Mihai V. Putz, D. Michael P. M ...
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Last edited by MARC Bot
September 5, 2024 | History

Applications of density functional theory to chemical reactivity

Mihai V. Putz  Density Functional Theory of Bose-Einstein Condensation: Road to Chemical Bonding Quantum Condensate

Roman F. Nalewajski  Information Theory Insights into Molecular Electronic Structure and Reactivity

George Maroulis         Applying Conventional Ab Initio and Density Functional Theory Approaches to Electric Property Calculations. Quantitative Aspects and Perspectives.

Sourav Pal Descriptors as Probes for Inter-Molecular Interactions and External Perturbation

Abhijit Chatterjee       Application of Reactivity Indices within Density Functional Theory to Rationale Chemical Interactions

Publish Date
Publisher
Springer
Language
English
Pages
189

Buy this book

Edition Availability
Cover of: Applications of Density Functional Theory to Chemical Reactivity
Applications of Density Functional Theory to Chemical Reactivity
Jun 25, 2015, Springer
paperback
Cover of: Applications of density functional theory to chemical reactivity
Applications of density functional theory to chemical reactivity
2012, Springer
in English

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Book Details


Table of Contents

Density functional theory of Bose-Einstein condensation: road to chemical bonding quantum condensate / Mihai V. Putz
Information theory Insights into molecular electronic structure and reactivity / Roman F. Nalewajski
Applying conventional ab initio and density functional theory approaches to electric property calculations. Quantitative aspects and perspectives / George Maroulis
Descriptors as probes for inter-molecular interactions and external perturbation / Sourav Pal
Application of reactivity indices within density functional theory to rationale chemical interactions / Abhijit Chatterjee.

Edition Notes

Includes bibliographical references and index.

Published in
Heidelberg, New York
Series
Structure and bonding -- 149, Structure and bonding -- 149.
Copyright Date
2012

Classifications

Library of Congress
QD462.6.D45 A77 2012, QD461 .S92 v.149, QD146-197

The Physical Object

Pagination
ix, 189 pages
Number of pages
189

ID Numbers

Open Library
OL31118682M
ISBN 10
3642327524, 3642327532
ISBN 13
9783642327520, 9783642327537
LCCN
2012955472
OCLC/WorldCat
806019897

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September 5, 2024 Edited by MARC Bot import existing book
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