示例#1
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 def sg_mol(**kwargs):
     kwargs['ret_geometry'] = True
     if 'geom' not in kwargs:
         kwargs['geom'] = self.mol
     return sgeom(**kwargs)
示例#2
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文件: test_sgeom.py 项目: silsgs/sisl
 def test_cite(self):
     sgeom(argv=['--cite'])
示例#3
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文件: test_sgeom.py 项目: silsgs/sisl
 def test_version(self):
     sgeom(argv=['--version'])
示例#4
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文件: test_sgeom.py 项目: silsgs/sisl
 def test_help(self):
     with pytest.raises(SystemExit):
         sgeom(argv=['--help'])
示例#5
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文件: test_sgeom.py 项目: silsgs/sisl
 def sg_g(**kwargs):
     kwargs['ret_geometry'] = True
     if 'geometry' not in kwargs:
         kwargs['geometry'] = self.g
     return sgeom(**kwargs)
示例#6
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 def sg_mol(**kwargs):
     kwargs['ret_geometry'] = True
     if 'geom' not in kwargs:
         kwargs['geom'] = self.mol
     return sgeom(**kwargs)