Dear Users,
I am getting following error message after running a small Gaussian
calculation.
*
No NMR shielding tensors so no spin-rotation constants.
Leave Link 601
(Enter g03/l602.exe)
Merz-Kollman atomic radii used.
Atom Element Radius
1 16 1.75
2 6 1.50
3 6 1.50
4 8 1.40
5 8 1.40
6 7 1.50
7 1 1.20
8 1 1.20
9 1 1.20
10 6 1.50
11 1 1.20
12 1 1.20
13 1 1.20
14 26 0.00
GetVDW: no radius for atom 14 atomic number 26.
Error termination via Lnk1e in g03/l602.exe
*
How can I get the GetVDW for atomic no 14 in Gaussian. Do I need to
mention it in the beginning of the input Gaussian file
like Pop=(ReadRadii)! Any help. Thanks in advance
s
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Received on Sun Jan 20 2008 - 06:07:07 PST
