[CP2K-user] [CP2K:17852] Re: Electron density cube units
Matt Watkins
mattwatkinsuk at gmail.com
Wed Oct 12 16:44:02 UTC 2022
per cubic bohr
On Wednesday, 12 October 2022 at 13:40:19 UTC+1 mdsimula... at gmail.com wrote:
> Hi,
>
> What are the units for the electron density in the E_DENSITY cube files?
> electron charge per cubic angstrom?
>
> Thanks,
> Frank
>
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