root / ase / calculators / jacapo / pbe_psp.py @ 19
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1 | 1 | tkerber | # Copyright (C) 2005 jrk
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2 | 1 | tkerber | |
3 | 1 | tkerber | """ Default pseudopotential paths are defined here
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4 | 1 | tkerber | """
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5 | 1 | tkerber | |
6 | 1 | tkerber | __docformat__ = 'reStructuredText'
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7 | 1 | tkerber | |
8 | 1 | tkerber | defaultpseudopotentials = {'O':'008-O-gpbe-rc_1_3_nlc.uspp', |
9 | 1 | tkerber | 'Pd':'046-Pd-gpe-n-6projectors-floc.uspp', |
10 | 1 | tkerber | 'Ag':'047-Ag-gpe-n-floc.uspp'} |