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[abinit-forum] Energy during Molecular Dynamic Simulation

From: <christoph.troetschler@uni-rostock.de>
To: forum@abinit.org
Subject: [abinit-forum] Energy during Molecular Dynamic Simulation
Date: Fri, 18 Dec 2009 20:42:01 +0100 (CET)

Hello,

how can I obtain the full information of the energy (at least the information
of the internal energy) after each timestep in a MD-calculation? I am
investigating liquid nitrogen using the Nose-Hoover-thermostat (ionmov 8).

Many thanks in advance!
Christoph

[abinit-forum] Energy during Molecular Dynamic Simulation, christoph.troetschler, 12/18/2009