Fermi-Löwdin orbital self-interaction correction using the optimized effective potential method within the Krieger-Li-Iafrate approximation

被引：0

作者：

Diaz, Carlos M. ^{[1
]}

Baruah, Tunna ^{[1
]}

Zope, Rajendra R. ^{[1
]}

机构：

[1] Department of Physics, University of Texas at El Paso, El Paso,TX,79968, United States

来源：

arXiv | 2021年

关键词：

Atomization energies - Eigen-value - Energy atomization - Hydrogen molecule - Krieger-li-iafrate approximations - Optimized effective potential method - Orbitals - Polarizabilities - Self-interaction corrections - Self-interaction error;

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摘要：

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