published Published 5 months ago
DWBuilder: A code to generate ferroelectric/ferroelastic domain walls and multi-material atomic interface structures
Python
published Published 8 months ago
PAPRECA: A parallel hybrid off-lattice kinetic Monte Carlo/molecular dynamics simulator
C++ C
published Published 10 months ago
Mold: a LAMMPS package to compute interfacial free energies and nucleation rates
C++
published Published 12 months ago
CLEAVING: a LAMMPS package to compute surface free energies
C++ Python Fortran
published Published over 1 year ago
MLMOD: Machine Learning Methods for Data-Driven Modeling in LAMMPS
Python C++
published Published almost 2 years ago