Пример #1
0
 def __init__(self, cell, kpt=numpy.zeros(3)):
     pbcrohf.ROHF.__init__(self, cell, kpt)
     rks._dft_common_init_(self)
Пример #2
0
 def __init__(self, cell, kpt=numpy.zeros(3)):
     rohf.ROHF.__init__(self, cell, kpt)
     rks._dft_common_init_(self)
Пример #3
0
 def __init__(self, cell, kpts=np.zeros((1, 3))):
     khf.KRHF.__init__(self, cell, kpts)
     rks._dft_common_init_(self)
Пример #4
0
 def __init__(self, cell, kpts=np.zeros((1,3))):
     khf.KRHF.__init__(self, cell, kpts)
     rks._dft_common_init_(self)