示例#1
0
文件: xyz.py 项目: hornos/pypak
 def __init__( self, path = None, opts = "", sysopts = { "verbose" : False, "debug" : False } ):
   File.__init__( self, path, opts, sysopts )
   self.geom = Geometry( 'xyz' )
   self.species = {}
示例#2
0
文件: UPOT.py 项目: hornos/pyf3
 def __init__( self, path = None, opts = "", sysopts = { "verbose" : False, "debug" : False } ):
   File.__init__( self, path, opts, sysopts )
   self.geom = Geometry( 'UPOT' )
   self.reference = None