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Direct energy functional minimization under orthogonality constraints
Weber, Valéry, VandeVondele, Joost, Hutter, Jürg, Niklasson, Anders M. N.Volume:
128
Year:
2008
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.2841077
File:
PDF, 713 KB
english, 2008