[lammps-users] [problem energy]

Hello I have problem in lammps 2010 can not play same
result a temperature 10 kelvin (solid phase), i did in lammps 2008, energy

potencial is different, volumen and distribution function g(r) very
differente,
potential meam in lammps 2010 compute energy cohesive different value in
lammps
2008.

Ga.meam (76 Bytes)

library.meam (9.56 KB)

Your script is 100s of lines long. No one is likely to investigate
this unless you provide more details. Is the initial thermo
output the same? Does the new run vs old run slowly diverge
or somethng more dramatic? Have you tried it with NVE,
then NVT, then NPT?

Steve