The self-interaction correction in the time domain

Dinh PM, Messud J, Reinhard PG, Suraud E (2010)

Publication Type: Conference contribution

Publication year: 2010

Publisher: Institute of Physics Publishing

Book Volume: 248

Conference Proceedings Title: Journal of Physics: Conference Series

DOI: 10.1088/1742-6596/248/1/012024

Abstract

We provide a brief outline of the Self Interaction Correction (SIC) used in connection with the Local Density Approximation (LDA) of Density Functional Theory (DFT), pointing out especially the implications for Time Dependent theories (TDDFT). We discuss how the self-interaction problem can be resolved by a clean formulation of the SIC theory including in an explicit manner the ortho-normalization of Kohn Sham orbitals. We finally show a few examples of applications of the theory. © 2010 IOP Publishing Ltd.

Authors with CRIS profile

Paul-Gerhard Reinhard Naturwissenschaftliche Fakultät

Involved external institutions

Université Fédérale de Toulouse Midi-Pyrénées FR France (FR)

How to cite

APA:

Dinh, P.M., Messud, J., Reinhard, P.-G., & Suraud, E. (2010). The self-interaction correction in the time domain. In Journal of Physics: Conference Series. Institute of Physics Publishing.

MLA:

Dinh, P. M., et al. "The self-interaction correction in the time domain." Proceedings of the Journal of Physics: Conference Series Institute of Physics Publishing, 2010.

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