TrinkleGroup / LatticeGreenFunction_newLinks
Computation of lattice Green function for dislocation topologies
☆11Updated 6 years ago
Alternatives and similar repositories for LatticeGreenFunction_new
Users that are interested in LatticeGreenFunction_new are comparing it to the libraries listed below
Sorting:
- A module for ASE for elastic constants calculation.☆42Updated 4 months ago
- ☆20Updated last year
- A command line tool written in Python/C++ for finding optimized SQS structures☆46Updated this week
- Massively parallel vibrational mode calculator.☆23Updated 9 months ago
- A code to estimate transport coefficients from the cepstral analysis of a (multi)variate current stationary time series -- [FKA "thermoce…☆42Updated 5 months ago
- A solver for the coupled and decoupled electron and phonon Boltzmann transport equations.☆51Updated last week
- Generating k-point grids with the best folding ratio or fewest irreducible k-points for a given density☆38Updated 9 months ago
- A computational framework to automate point defect calculations☆36Updated 7 years ago
- Interfacial Phonon code☆26Updated 2 years ago
- Tools for phase field crystal modeling of two-dimensional materials.☆19Updated 5 years ago
- A toolkit for automatic calculation and analysis of elastic constants☆50Updated last year
- Basic programs for generating Slater-Koster files for the DFTB-method☆26Updated 4 months ago
- OpenIEC: An open-source code for interfacial energy calculation in alloys☆36Updated last year
- Site-Occupation Disorder☆43Updated 2 months ago
- Toolkit using the Atomistic Simulation Environment (ASE)☆19Updated 5 years ago
- A c++ code to convert bestsqs.out from mcsqs (ATAT) to POSCAR for VASP.☆32Updated 9 years ago
- generator of simple atomistic models☆28Updated 6 years ago
- A general linear model for microkinetic catalytic systems.☆10Updated 2 years ago
- Extracts full elastic tensor from VASP OUTCAR and calculates some useful quantities☆26Updated 9 years ago
- AICON2: A program for calculating transport properties quickly and accurately☆15Updated last year
- Unsupervised landmark analysis for jump detection in molecular dynamics simulations.☆13Updated 4 years ago
- DensityTool post-processing program for VASP