6 package(s) known
atompaw
4.1.1.0 (4.1.1.0-1)
Summary: Tool to generate projector and basis functions needed for performing electronic structure calculations based on the projector augmented wave (PAW) method.
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Summary: Tool for projector augmented wave functions for molecular simulations
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sci-physics/atompaw
4.1.1.0
Summary: PAW atomic data generator
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Summary: Software for generating PAW atomic datasets to be used by first-principle simulation codes
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Summary: PAW dataset generator for 1st-principle simulations
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