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Theoretical methods in condensed phase chemistry

Author: Steven David Schwartz
Publisher: Dordrecht ; Boston : Kluwer Academic Publishers, ©2000.
Series: Progress in theoretical chemistry and physics, v. 5.
Edition/Format:   eBook : Document : EnglishView all editions and formats
Database:WorldCat
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Genre/Form: Electronic books
Additional Physical Format: Print version:
Theoretical methods in condensed phase chemistry.
Dordrecht ; Boston : Kluwer Academic Publishers, ©2000
(DLC) 00049304
Material Type: Document, Internet resource
Document Type: Internet Resource, Computer File
All Authors / Contributors: Steven David Schwartz
ISBN: 0306469499 9780306469497
OCLC Number: 70736479
Reproduction Notes: Electronic reproduction. [S.l.] : HathiTrust Digital Library, 2010. MiAaHDL
Description: 1 online resource (xi, 304 pages) : illustrations.
Details: Master and use copy. Digital master created according to Benchmark for Faithful Digital Reproductions of Monographs and Serials, Version 1. Digital Library Federation, December 2002.
Contents: Classical and quantum rate theory for condensed phases / Eli Pollak --
The GLE as a paradigm of condensed phase systems --
Variational rate theory --
Turnover theory --
Quantum rate theory --
Feynman path centroid dynamics / Gregory A. Voth --
The centroid distribution function --
Exact formulation of centroid dynamics --
The centroid molecular dynamics approximation --
Some applications of centroid molecular dynamics --
Proton transfer in condensed phases: beyond the quantum Kramers paradigm / Dimitri Antoniou, Steven D. Schwartz --
Calculation of quantum transfer rates --
Rate promoting vibrations --
Position-dependent friction --
Effect of low-frequency modes of the environment --
Nonstationary stochastic dynamics and applications to chemical physics / Rigoberto Hernandez, Frank L. Somer, Jr. --
Nonstationary stochastic models --
Application to polymer systems --
Application to protein folding --
Orbital-free kinetic-energy density functional theory / Yan A. Wang, Emily A. Carter --
The Thomas-Fermi model and extensions --
The von Weizsacker model and extensions --
Correct response behavior --
Nonlocal density approximations --
Numerical implementations --
Applications and future prospects --
Semiclassical surface hopping methods for nonadiabatic transitions in condensed phases / Michael F. Herman --
Semiclassical surface-hopping methods for nonadiabatic problems --
Numerical calculations of vibrational population relaxation --
Mechanistic studies of solvation dynamics in liquids / Branka M. Ladanyi.
Series Title: Progress in theoretical chemistry and physics, v. 5.
Responsibility: edited by Steven D. Schwartz.
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Abstract:

Presents advances in the theory of chemical processes in the condensed phase. The approaches and applications studied in the book vary widely from classical to quantum mechanics, encompassing a range  Read more...

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