On Tue, Apr 06, 2010, John S wrote:
>
> While using antechamber for partial charge generation using Mulliken charge
> .Is it alright if I use fractional net charge .
> Does antechamber recognize fractional charges as net charge .
No; the argument to -nc is an integer.
...dac
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Received on Tue Apr 06 2010 - 05:00:02 PDT
