예제 #1
0
파일: direct_uhf.py 프로젝트: pengdl/pyscf 
def trans_rdm1s(cibra, ciket, norb, nelec, link_index=None):
    return direct_spin1.trans_rdm1s(cibra, ciket, norb, nelec, link_index)
예제 #2
0
 def qud(v1, v2):
     dma, dmb = direct_spin1.trans_rdm1s(v1, v2, norb, nelec)
     return dma, dmb
예제 #3
0
def trans_rdm1s(cibra, ciket, norb, nelec, link_index=None):
    return direct_spin1.trans_rdm1s(cibra, ciket, norb, nelec, link_index)
예제 #4
0
 def qud(v1, v2):
     dma, dmb = direct_spin1.trans_rdm1s(v1, v2, norb, nelec)
     return dma, dmb