tyst3273 / phonon-transmission
Harmonic phonon transmission calculations from molecular dynamics trajectories
☆11Updated 5 years ago
Related projects ⓘ
Alternatives and complementary repositories for phonon-transmission
- (NEW) Tools for computing spectral heat current distribution using LAMMPS NEMD simulations.☆26Updated 5 months ago
- Calculates Projected Phonon Spectral Energy Density (SED) from molecular dynamics atomic velocity data and phonon eigenvectors☆16Updated 4 years ago
- This API_Phonons is a set of python scripts and functions for interfacing different packages for phonon modeling.☆20Updated last week
- Calculation of phonon participation rates - used to characterize atomic vibrational information including the degree of localization and …☆22Updated 2 years ago
- Python program for analyzing the output files of phonopy.☆13Updated 3 years ago
- To implement the phonon SED (spectral energy desity) method in 2010, phonon lifetime can be calculated.☆22Updated last month
- A 200-line Matlab implementation of the Atomistic Green's function (AGF) method for phonon transport☆25Updated 4 years ago
- Wavelike and Particlelike Phonon Transport (WPPT) Solver☆25Updated 8 months ago
- Post-processing of electron-phonon coupling calculations from Abinit☆16Updated 3 years ago
- A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.☆30Updated 2 years ago
- Tutorials on atomic simulations related to my research☆27Updated 2 years ago
- topoPhonon package is a python package that allows users to calculate topological properties (berry phase, berry curvature, wannier charg…☆22Updated 2 weeks ago
- This GitHub repository contains additional information supporting published manuscripts☆16Updated 2 months ago
- GPUMD and LAMMPS helper functions for thermal computations☆25Updated 2 years ago
- Tools for computing spectral heat current distribution using LAMMPS NEMD simulations.☆16Updated 4 years ago
- Allen-Feldman thermal conductivity compatible to GULP implementation☆17Updated last month
- Interfacial Phonon code☆25Updated 2 years ago
- Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory☆19Updated 4 years ago
- Python tools for calculating the spectral heat current distribution from LAMMPS NEMD simulations☆27Updated 2 years ago
- ☆18Updated 5 years ago
- some toolkits for VASP☆27Updated 3 years ago
- A collection of tips, scripts, tools and files to improve your workflow, or simply help you start with ab initio Molecular Dynamics (AIMD…☆18Updated last year
- DFT post processing tools☆23Updated 3 months ago
- A lite tool for monitoring convergence in VASP relaxation☆15Updated 4 months ago
- Non-equilibrium green's function method☆15Updated 8 years ago
- Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP☆22Updated 4 years ago
- Scripts for analyzing VASP output and preparing VASP input, especially for NEB calculations.☆16Updated 5 years ago
- Python codes to calculate phonon spectral energy density from LAMMPS velocity data.☆24Updated 3 years ago
- Tools for Phono(3)py power users.☆30Updated last year
- Builds 2D heterostructures via coincidence lattice theory.☆12Updated last year