Proper treatment of symmetries and excited states in a computationally tractable Kohn-Sham method

Görling A (2000)


Publication Type: Journal article, Original article

Publication year: 2000

Journal

Original Authors: Görling A.

Publisher: American Physical Society

City/Town: Woodbury, NY, United States

Book Volume: 85

Pages Range: 4229-4232

Journal Issue: 20

DOI: 10.1103/PhysRevLett.85.4229

Abstract

The symmetrized Kohn-Sham (KS) formalism and the generalized adiabatic connection-KS (GAC-KS) formalism are combined to a symmetrized GAC-KC formalism. It is demonstrated how the required potentials and energies can be determined. As an example, excited states of the carbon atom and the carbon monoxide molecule are considered.

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How to cite

APA:

Görling, A. (2000). Proper treatment of symmetries and excited states in a computationally tractable Kohn-Sham method. Physical Review Letters, 85(20), 4229-4232. https://doi.org/10.1103/PhysRevLett.85.4229

MLA:

Görling, Andreas. "Proper treatment of symmetries and excited states in a computationally tractable Kohn-Sham method." Physical Review Letters 85.20 (2000): 4229-4232.

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