[gmx-users] Re: vaccum simulation error
erikm at xray.bmc.uu.se
Tue Feb 19 13:55:56 CET 2013
Ponder this: What is the pressure of vacuum?
On Feb 19, 2013, at 12:32 PM, raji wrote:
> for vacuum simulation , no need to specify cut-offs right. am using
> 8x8x8 box
> and if we don't specify barostat it will again be a NVT simulations
> vacuum simulations can be done only in NVT ??
> sorry if am wrong . please clarify this doubt
> thanks in advance
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