fractional CHARGE

Matt W mattwa... at
Thu Jan 4 15:25:46 UTC 2018

This can't be done at the moment, unfortunately.

On Wednesday, January 3, 2018 at 2:08:55 PM UTC, Xiaoming Wang wrote:
> Hi,
> It seems that the parameter CHARGE only accepts integer values. Now, I'd 
> like to calculate the energy of a periodic system as a function of 
> factional charge. For self-interaction free functionals, the total energy 
> curve between two integer charge states should be linear. I want to confirm 
> this for my case. So is there a way to calculate fractional charged systems?
> Best,
> Xiaoming
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