Template:MDCOMBINATIONS

From VASP Wiki
Revision as of 17:52, 4 July 2019 by Karsai (talk | contribs)
Thermostat
Ensemble Andersen Nose-Hoover Langevin Multiple Andersen
NVE MDALGO=1, ANDERSEN_PROB=0.0
NVT MDALGO=1 MDALGO=2 MDALGO=3 MDALGO=13
ISIF=2 ISIF=2 ISIF=2 ISIF=2
NpT not available not available MDALGO=3 not available
ISIF=3
NpH not available not available MDALGO=3 not available
ISIF=3
Retrieved from "https://www.vasp.at/wiki/index.php?title=Template:MDCOMBINATIONS&oldid=9305"