Direct minimization technique for metals in density-functional theory

Freysoldt, C.; Boeck, S.; Neugebauer, J.

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Direct minimization technique for metals in density-functional theory

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Freysoldt, C.
Defect Chemistry and Spectroscopy, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society;

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Boeck, S.
Algorithm Design and Modelling, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society;

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Neugebauer, J.
Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society;

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Freysoldt, C., Boeck, S., & Neugebauer, J. (2009). Direct minimization technique for metals in density-functional theory. Physical Review B, 79: 241103(R), pp. 241103-1-241103-4.

Cite as: https://hdl.handle.net/11858/00-001M-0000-0019-40DF-7

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