Mixed time-dependent density-functional theory/classical trajectory surface hopping study of oxirane photochemistry
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.2978380
Reference120 articles.
1. Time-Dependent Density Functional Response Theory for Molecules
2. Dynamic polarizabilities and excitation spectra from a molecular implementation of time‐dependent density‐functional response theory: N2as a case study
3. Treatment of electronic excitations within the adiabatic approximation of time dependent density functional theory
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