The maximum number of atoms is (default) 1000, and can be set in the
if needed (you need to recompile afterwards !).
On Feb 9, 2005, at 4:28 PM, Masroor Ahmad wrote:
> Hi List,
> I want to know if there is any upper limit on the number of atoms in
> system being calculated with ADF? And what if ADF returns an error:
> -----too many records (ATOMS).
You have reached the maximum number of atoms.
dr. Marcel Swart
Vrije Universiteit Amsterdam
Faculteit der Exacte Wetenschappen
De Boelelaan 1083
1081 HV Amsterdam
Received on 2005-02-10 10:42:09
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