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[ESPResSo-users] Units of Temp and time step
From: |
Muhammad Anwar |
Subject: |
[ESPResSo-users] Units of Temp and time step |
Date: |
Fri, 1 Apr 2011 11:15:24 +0200 |
User-agent: |
Thunderbird 2.0.0.24 (X11/20101027) |
Hello,
Dear User,
I am using Kcal/mol for energy and Angstrom for distance, I want to set
temperature of 300 K in Langevin thermostat and time step of 1 fs. Will
i write simply:
setmd time_step 1
thermostat langevin 1.0 1.0
or need some conversion? If need conversion then in which units i will
put temperature and time step?
Thanks in advance.
Best Regards,
Muhammad Anwar
- [ESPResSo-users] Units of Temp and time step,
Muhammad Anwar <=