Direct Minimization for Calculating Invariant Subspaces in Density Functional Computations of the Electronic Structure

Reinhold Schneider, Thorsten Rohwedder, Alexey Neelov, Johannes Blauert

Journal of Computational Mathematics ›› 2009, Vol. 27 ›› Issue (2-3) : 360-387.

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PDF(331 KB)
Journal of Computational Mathematics ›› 2009, Vol. 27 ›› Issue (2-3) : 360-387.

Direct Minimization for Calculating Invariant Subspaces in Density Functional Computations of the Electronic Structure

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