mirror of https://github.com/QMCPACK/qmcpack.git
nexus: update default coord input for gamess
git-svn-id: https://subversion.assembla.com/svn/qmcdev/trunk@7005 e5b18d87-469d-4833-9cc0-8cdfa06e9491
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@ -1118,7 +1118,9 @@ def generate_any_gamess_input(**kwargs):
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bss = nexus_noncore.basissets.bases_by_atom(*pskw.bases)
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else:
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bss = obj()
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gi.contrl.coord = 'cart'
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if 'coord' not in gi.contrl:
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gi.contrl.coord = 'unique'
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#end if
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#end if
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for i in range(len(elem)):
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a = elem[i]
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