NextZenStudent / Intrinsic-Stacking-Fault-EnergyLinks
LAMMPS code for stacking fault energy calculation
☆11Updated 5 years ago
Alternatives and similar repositories for Intrinsic-Stacking-Fault-Energy
Users that are interested in Intrinsic-Stacking-Fault-Energy are comparing it to the libraries listed below
Sorting:
- POST code for second order elastic constant☆46Updated 5 years ago
- A MATLAB program for simulating film growth using Kinetic Monte Carlo.☆15Updated 4 years ago
- 收集和整理适用于高熵合金分子动力学模拟的势函数。A set of interatomic potentials suitable for molecular dynamics simulations of high entropy alloys.☆37Updated 3 weeks ago
- Python codes to calculate phonon spectral energy density from LAMMPS velocity data.☆29Updated 4 years ago
- Some scripting tools used for lammps input or output☆62Updated 8 months ago
- A grain boundary generation code☆79Updated 2 years ago
- A toolkit for automatic calculation and analysis of elastic constants☆54Updated last year
- This tutorial explains how to use ATAT to generate SQS for disordered alloys. It covers basic steps of creating a unit cell, generating c…☆16Updated 2 years ago
- some toolkits for VASP☆33Updated 4 years ago
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆55Updated 3 years ago
- This repository contains 'sample' LAMMPS input scripts for molecular dynamics thermal conductivity simulation and phonon mode analysis, v…☆14Updated 2 years ago
- XDATCAR_toolkit- A tool for convert XDATCAR to PDB☆63Updated 6 years ago
- LAMMPS scripts to simulate uniaxial tensile test of a graphene Sample☆36Updated 5 years ago
- Extracts full elastic tensor from VASP OUTCAR and calculates some useful quantities☆26Updated 10 years ago
- GPUMD and LAMMPS helper functions for thermal computations☆26Updated 3 years ago
- generator of simple atomistic models☆28Updated 7 years ago
- Calculate 3rd order elastic constant.☆13Updated 9 months ago
- VASPKIT_manual markdown source!☆82Updated 6 years ago
- Kinetic Monte Carlo of Systems (KMCOS): lattice based kinetic Monte Carlo with a python front-end and Fortran back-end.☆24Updated 6 months ago
- CP2K Editor is a simple GUI for creating input files in the atomistic program CP2K. It is a easy and fast way to create the complex input…☆56Updated 6 years ago
- Tutorials on atomic simulations related to my research☆31Updated 3 years ago
- Ferroelectric/Ferroelastic domain wall builder☆23Updated last year
- 针对开源模拟软件Lammps导出的数据文件,个人采用Python脚本进行数据处理并科研绘图,并取得相关的论文成果。☆50Updated 4 years ago
- A software to calculate thermal conductivity quickly and accurately☆35Updated 5 years ago
- Source codes of the 1st VASPKIT-PAPATERA CUP Awards☆27Updated 6 years ago
- Calculation of phonon participation rates - used to characterize atomic vibrational information including the degree of localization and …☆24Updated last month
- ☆19Updated 6 years ago
- Python scripts for dealing with molecular dynamics script for LAMMPS☆18Updated 3 years ago
- Fix lattice component(s) during relaxation in VASP☆135Updated last month
- ☆60Updated last year