[CP2K-user] Shape of simulation cell in QMMM simulations
Matt W
mattwa... at gmail.com
Sun Jul 28 18:56:20 UTC 2019
Yes.
On Saturday, July 27, 2019 at 5:38:20 AM UTC+1, Nam Tran wrote:
>
> Dear CP2K experts
>
> According to this excercise '
> https://www.cp2k.org/exercises:2018_ethz_mmm:qmmm_2018' then the shape of
> simulation cell in QMMM simulations must be orthorhombic,Is that true ?
>
> Best Regards
> Nam
>
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