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Low-Lying Potential Energy Surfaces
Non-Adiabatic Bending Dissociation of OCS Induced by Orbital Unlocking
other
Author(s):
Toshinori Suzuki
,
Shinkoh Nanbu
Publication date
(Online):
July 23 2009
Publisher:
American Chemical Society
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Author and book information
Book Chapter
Publication date (Print):
August 14 2002
Publication date (Online):
July 23 2009
Pages
: 300-313
DOI:
10.1021/bk-2002-0828.ch014
SO-VID:
86aaa395-49c6-4c73-946e-ed0e2992ba96
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Book chapters
pp. 1
Overview: Accurate Description of Low-Lying Electronic States and Potential Energy Surfaces
pp. 10
Simultaneous Account of Dynamic and Nondynamic Correlations Based on Complementarity of CI and CC Approaches
pp. 31
Method of Moments of Coupled-Cluster Equations: A New Theoretical Framework for Designing "Black-Box" Approaches for Molecular Potential Energy Surfaces
pp. 93
Coupled Cluster Methods for Bond-Breaking
pp. 109
State-Specific Multireference Coupled Cluster-Based Methods for Potential Energy Surfaces and Their Approximate Variants
pp. 154
The Excited and Ion States of Allene
pp. 176
Hamiltonian Matrix Elements for the Table-CI Method Using Genealogical Configuration State Functions
pp. 199
Jacob's Ladder for Time-Dependent Density-Functional Theory: Some Rungs on the Way to Photochemical Heaven
pp. 221
Spectral Theory of Chemical Bonding
pp. 238
Comparison of CaF, ZnF, CaO, and ZnO: Their Anions and Cations in Their Ground and Low-Lying Excited States
pp. 260
TheX1(2Π3/2) andX2(2Π1/2) Potentials of the Halogen Monoxides: A Comparison of RKR and Ab Initio Results
pp. 276
Symmetry in Spin-Orbit Coupling
pp. 300
Non-Adiabatic Bending Dissociation of OCS Induced by Orbital Unlocking
pp. 314
Electronic Structure and Dynamics in the O4System
pp. 329
Model Studies of Intersystem Crossing Effects in the O + H2Reaction
pp. 346
The Challenge of High-Resolution Dynamics: Rotationally Mediated Unimolecular Dissociation of HOCl
pp. 361
The Electronic Adiabatic-to-Diabatic Transformation Matrix and the Irreducible Representation of the Rotation Group
pp. 380
Spectroscopic Determination of Potential Energy Surfaces for the Out-of-Plane Ring Vibrations of Indan and Related Molecules in Their S0and S1(Π, Π*) States
pp. 400
Semiclassical Time Evolution in the Forward-Backward Stationary-Phase Limit
pp. 418
Development and Application of an Ab Initio Methane-Water Potential for the Study of Phase Equilibria of Methane Hydrates
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