def get_system_atoms(self, system=None):
"""
Returns a list of the atom kinds and number of atoms of the surface or solid system
atom_kind : list
atom_number : list
"""
if system == 'surface':
system_directory = self.sysdir_check()[0]
if system == 'solid':
system_directory = self.sysdir_check()[1]
contcar = CONTCAR(os.path.join(system_directory, self.contcarfile))
atom_kind = contcar.read_atomkinds()
atom_number = contcar.read_atomnumbers()
return atom_kind, atom_number
def get_system_atoms(self, system=None):
"""
Returns a list of the atom kinds and number of atoms of the surface '
'or solid system
atom_kind : list
atom_number : list
"""
if system == 'surface':
system_directory = self.sysdir_check()[0]
if system == 'solid':
system_directory = self.sysdir_check()[1]
contcar = CONTCAR(os.path.join(system_directory, self.contcarfile))
atom_kind = contcar.read_atomkinds()
atom_number = contcar.read_atomnumbers()
return atom_kind, atom_number
