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Direct minimization technique for metals in density-functional theory

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

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

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Neugebauer,  Jörg
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. 1-4. doi:10.1103/PhysRevB.79.241103.


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