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commita894e81afb10dc2ef615a4591186a81c1010b1b0
authorlidaobing <lidaobing>
Sun, 24 Jun 2007 22:33:33 +0000 (24 22:33 +0000)
committerlidaobing <lidaobing>
Sun, 24 Jun 2007 22:33:33 +0000 (24 22:33 +0000)
tree73e780381b59aa2f6f9a10f6fcb66a3ee0feead2tree | snapshot (tar.gz zip)
parentbde7951f6c399a0e50799d8f976fefd94433c8f6commit | diff
calculation Hirshfeld charge from gaussian's fchk file.