Analytic projection from plane-wave and PAW wavefunctions...

Journal of Computational Chemistry 2013 / 11 Vol. 34; Iss. 29

Analytic projection from plane-wave and PAW wavefunctions and application to chemical-bonding analysis in solids

Maintz, Stefan, Deringer, Volker L., Tchougréeff, Andrei L., Dronskowski, Richard
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Volume:
34
Language:
english
Journal:
Journal of Computational Chemistry
DOI:
10.1002/jcc.23424
Date:
November, 2013
File:
PDF, 1.09 MB
english, 2013
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