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Properties of Chemically Interesting Potential Energy Surfaces
Language: en
Pages: 193
Authors: Dietmar Heidrich
Categories: Science
Type: BOOK - Published: 2012-12-06 - Publisher: Springer Science & Business Media

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Contemporary chemical reaction theory is the characterization of Potential Energy Hypersurfaces (PES). The authors critically analyze chemically and mathematica
Potential Energy Surfaces and Dynamics Calculations
Language: en
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Authors: Donald Truhlar
Categories: Science
Type: BOOK - Published: 2013-11-11 - Publisher: Springer Science & Business Media

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The present volume is concerned with two of the central questions of chemical dynamics. What do we know about the energies of interaction of atoms and molecules
Potential Energy Surfaces
Language: en
Pages: 242
Authors: Alexander F. Sax
Categories: Science
Type: BOOK - Published: 2012-12-06 - Publisher: Springer Science & Business Media

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Potential Energy Surfaces is a collection of lectures given at the 1996 Mariapfarr Workshop in Theoretical Chemistry, organized by Alexander F. Sax. The Mariapf
Exploration on Quantum Chemical Potential Energy Surfaces
Language: en
Pages: 273
Authors: Koichi Ohno
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Type: BOOK - Published: 2022-12-12 - Publisher: Royal Society of Chemistry

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Providing several examples, this book describes fundamental methods and techniques specific for efficient exploration on the potential energy surface by quantum
Research in Atomic Structure
Language: en
Pages: 143
Authors: S. Fraga
Categories: Science
Type: BOOK - Published: 2012-12-06 - Publisher: Springer Science & Business Media

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Impressive advances have been made in the study of atomic structures, at both the experimental and theoretical levels. And yet, the scarcity of information on a