vishalsubbiah / Grain-Boundary-Energies-LAMMPSLinks
☆11Updated 9 years ago
Alternatives and similar repositories for Grain-Boundary-Energies-LAMMPS
Users that are interested in Grain-Boundary-Energies-LAMMPS are comparing it to the libraries listed below
Sorting:
- GPUMD and LAMMPS helper functions for thermal computations☆26Updated 3 years ago
- Calculation of phonon participation rates - used to characterize atomic vibrational information including the degree of localization and …☆24Updated last month
- GPUMD and LAMMPS helper functions for thermal computations☆10Updated 3 years ago
- Wavelike and Particlelike Phonon Transport (WPPT) Solver☆28Updated last year
- AICON2: A program for calculating transport properties quickly and accurately☆15Updated 2 years ago
- topoPhonon package is a python package that allows users to calculate topological properties (berry phase, berry curvature, wannier charg…☆26Updated 3 months ago
- Harmonic phonon transmission calculations from molecular dynamics trajectories☆14Updated 6 years ago
- Calculate 3rd order elastic constant.☆13Updated 9 months ago
- Builds 2D heterostructures via coincidence lattice theory.☆14Updated 2 years ago
- The thermal conductivity of a molecular dynamics system is calculated using the Green-Kubo fluctuation Dissipation Theorem☆14Updated 4 years ago
- (NEW) Tools for computing spectral heat current distribution using LAMMPS NEMD simulations.☆33Updated last year
- Calculates Projected Phonon Spectral Energy Density (SED) from molecular dynamics atomic velocity data and phonon eigenvectors☆20Updated 5 years ago
- Interfacial Phonon code☆28Updated 3 years ago
- BoltzTraP_Tools is an interface written using Python 2 language. It allows to parse and plot BoltzTraP output DATA☆18Updated 4 years ago
- A 200-line Matlab implementation of the Atomistic Green's function (AGF) method for phonon transport☆28Updated 5 years ago
- extract third order force constants from TDEP output☆10Updated 5 years ago
- Allen-Feldman thermal conductivity compatible to GULP implementation☆21Updated 9 months ago
- This is a GPU optimized version of ShengBTE.☆19Updated last year
- Python program for analyzing the output files of phonopy.☆14Updated 4 years ago
- Tools for computing spectral heat current distribution using LAMMPS NEMD simulations.☆16Updated 5 years ago
- A software to calculate thermal conductivity quickly and accurately☆35Updated 5 years ago
- An open-source C++ software for efficient nanoscale quantum transport simulations☆10Updated 6 years ago
- Tutorials on atomic simulations related to my research☆31Updated 3 years ago
- Python codes to calculate phonon spectral energy density from LAMMPS velocity data.☆29Updated 4 years ago
- cif2cell compatible with Python 3+☆12Updated 3 years ago
- Tools for Phono(3)py power users.☆34Updated 2 years ago
- This a toolkit repository to read, and analysis ab initio molecular dynamics simulations☆11Updated 4 years ago
- Extension of almaBTE's Monte Carlo code beyond the relaxation-time approximation.☆10Updated 2 years ago
- LAMMPS extension to capture electron-ion interaction. This is a mirror of https://gitlab.com/artuuuro/USER-EPH.☆18Updated 9 months ago
- ☆16Updated 6 years ago