GaussQ 1.0

19 07 2008

version 1.0
freeware
release May 30, 2008
by: TRN, LCAC, KASETSART UNIVERSITY, THAILAND
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Categories : Computational Chemistry

AOMIX

18 07 2008

AOMIXPAR.txt
DOS
0 5 0.5 0.05 0.5

1. aomix.exe
-use FILE.dat for MO sections

3
0 1 97 -2
SWNT1
0 98 132 -2
DPPYBF
0 133 229 -2
SWNT2

2. aomix-s.exe


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Tags:
Categories : Computational Chemistry