Note: Free energy calculations for atomic solids through the Einstein crystal/molecule methodology using GROMACS and LAMMPS
J Chem Phys
.
2012 Oct 14;137(14):146101.
doi: 10.1063/1.4758700.
Authors
J L Aragones
,
C Valeriani
,
C Vega
PMID:
23061870
DOI:
10.1063/1.4758700
No abstract available
Publication types
Letter