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[ESPResSo] NPT parameter problem
From: |
Xinghua Shi |
Subject: |
[ESPResSo] NPT parameter problem |
Date: |
Tue, 16 Jun 2009 10:12:23 -0400 |
Hi folks,
In the input file ~package/mbtools/scripts/main.tcl, the parameter for
NPT is something like
integrate set npt_isotropic $p_ext $piston_mass 1 1 0
Just curious about the extra parameters "1 1 0", which not exist in
the manual, so couldn't understand the meaning. Is it used to adjust
the box size?
Best regards
Xinghua
- [ESPResSo] NPT parameter problem,
Xinghua Shi <=