Modified Embedded Atom Method
Software
·
OSTI ID:1231596
Interatomic force and energy calculation subroutine to be used with the molecular dynamics simulation code LAMMPS (Ref a.). The code evaluated the total energy and atomic forces (energy gradient) according to a cubic spline-based variant (Ref b.) of the Modified Embedded Atom Method (MEAM) with a additional Stillinger-Weber (SW) contribution.
- Short Name / Acronym:
- MEAM+SW V. 1.0; 002751MLTPL01
- Site Accession Number:
- LLNL-CODE-588032
- Version:
- 01
- Programming Language(s):
- Medium: X; OS: n/a; Compatibility: Multiplatform
- Research Organization:
- Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States)
- Sponsoring Organization:
- USDOE
- DOE Contract Number:
- AC52-07NA27344
- OSTI ID:
- 1231596
- Country of Origin:
- United States
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