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Electronic structure packages: Two implementations of the projector augmented wave (PAW) formalism

Marc Torrent, N. A. W. Holzwarth, François Jollet, David Harris, Nicholas Lepley, Xiao Xu. Electronic structure packages: Two implementations of the projector augmented wave (PAW) formalism. Computer Physics Communications, 181(11):1862-1867, 2010. [doi]

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Marc Torrent

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N. A. W. Holzwarth

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François Jollet

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David Harris

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Nicholas Lepley

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Xiao Xu

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