Restricted density functional theory of linear time-dependent properties in open-shell molecules
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1577329
Reference56 articles.
1. Density-Functional Theory for Time-Dependent Systems
2. Time-Dependent Density-Functional Theory
3. KEY CONCEPTS IN TIME-DEPENDENT DENSITY-FUNCTIONAL THEORY
4. On the required shape corrections to the local density and generalized gradient approximations to the Kohn–Sham potentials for molecular response calculations of (hyper)polarizabilities and excitation energies
5. Ultranonlocality in Time-Dependent Current-Density-Functional Theory: Application to Conjugated Polymers
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