Dataset for: Mass-contrast dependence of kinetic-energy equipartition violation under nonlinear supratransmission in L12 intermetallics (Pt3Al, Cu3Au, Ni3Al)
Published: 21 July 2026| Version 1 | DOI: 10.17632/k8y77kf2hn.1
Contributor:
Andrei KochkinDescription
LAMMPS input scripts, crystal generator, analysis and figure scripts, per-run kinetic-energy time series (27 runs), sublattice VACF spectra and complete simulation logs for a molecular-dynamics study of kinetic-energy equipartition violation between heavy and light sublattices in harmonically driven L12 intermetallics Ni3Al, Cu3Au and Pt3Al. See README.md for structure, data formats and reproduction steps.
Files
Institutions
- Altai State UniversityAltai Krai, Barnaul
- Altai State Technical UniversityAltai Krai, Barnaul
Categories
Condensed Matter Physics, Molecular Dynamics