Geometric derivatives of excitation energies using SCF and DFT-Reference-Cited by-同舟云学术

Geometric derivatives of excitation energies using SCF and DFT

Published:1999-07 Issue:3-4 Volume:308 Page:249-255
ISSN:0009-2614
Container-title:Chemical Physics Letters
language:en
Short-container-title:Chemical Physics Letters

Author:

Van Caillie Carole,Amos Roger D.

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference32 articles.

1. Toward a systematic molecular orbital theory for excited states

2. M.E. Casida, in: J.M. Seminario (Ed.), Recent Developments and Applications of Moderen Density Functional Theory, Theoretical and Computational Chemistry, vol. 4, Elsevier, Amsterdam, 1996.

3. Dynamic polarizabilities and excitation spectra from a molecular implementation of time‐dependent density‐functional response theory: N2as a case study

4. Treatment of electronic excitations within the adiabatic approximation of time dependent density functional theory

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