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Time dependent DFT in natural orbitals

Published:2017-10 Issue: Volume:138 Page:426-434
ISSN:0927-0256
Container-title:Computational Materials Science
language:en
Short-container-title:Computational Materials Science

Author:

Vincendon M.,Lacombe L.,Dinh P.M.,Suraud E.,Reinhard P.G.

Funder

Institut Universitaire de France

CNRS

Publisher

Elsevier BV

Subject

Computational Mathematics,General Physics and Astronomy,Mechanics of Materials,General Materials Science,General Chemistry,General Computer Science

Reference62 articles.

1. Density-Functional Theory of Atoms and Molecules;Parr,1989

2. Density Functional Theory: An Approach to the Quantum Many-Body Problem;Dreizler,1990

3. Nobel Lecture: Electronic structure of matter—wave functions and density functionals

4. Density-Functional Theory for Time-Dependent Systems

5. TIME-DEPENDENT DENSITY FUNCTIONAL THEORY

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