rubel75 / mstarLinks
Effective mass calculation with DFT
☆16Updated 8 months ago
Alternatives and similar repositories for mstar
Users that are interested in mstar are comparing it to the libraries listed below
Sorting:
- TDEP Tutorials☆29Updated this week
- Introductory course on the Vienna Ab Initio Simulation Package (VASP) given by Dr. Federico Dattila at the Institute of Chemical Research…☆20Updated 2 years ago
- DefAP is a program developed to facilitate the exploration of a material's defect chemistry. A large number of features are provided and …☆20Updated last month
- Builds 2D heterostructures via coincidence lattice theory.☆14Updated last year
- VASP - Localized Orbital Locator + Electron Localizability Indicator☆17Updated 2 years ago
- Interfacial Phonon code☆26Updated 2 years ago
- bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…☆13Updated 3 years ago
- Tutorial files for alamode☆12Updated 10 months ago
- A crystallographic visualizer for Python, compatible with files from common softwares like Quantum ESPRESSO, VASP, CP2K, etc.☆21Updated 7 months ago
- Electron Transport (ELECTRA), open source code from the "GENESIS" project☆11Updated 3 months ago
- Script to generate distorted perovskite structures☆12Updated last year
- Corrections for formation energy and eigenvalues for charged defect simulations☆13Updated 2 years ago
- AICON2: A program for calculating transport properties quickly and accurately☆15Updated last year
- Projected Electronic Bands in Quantum Espresso☆14Updated last year
- Scripts to extract various properties from VASP OUTCAR file☆11Updated last year
- Natural Bond Orbital algorithm to handle systems characterized by periodic symmetry☆20Updated 3 years ago
- Set of codes to extract force constants from force-displacements data, calculate phonon dispersion (FOCEX) and thermal transport properti…☆16Updated 2 months ago
- BoltzTraP_Tools is an interface written using Python 2 language. It allows to parse and plot BoltzTraP output DATA☆19Updated 4 years ago
- Python program for analyzing the output files of phonopy.☆13Updated 3 years ago
- Wannier-orbital Basis Suite Towards Electronic-Structure Reconstruction☆15Updated last year
- Unfolding of first-principle electronic band structure☆13Updated 2 years ago
- Python Package to Calculate IR Intensities from the Dipole Approximation with Phonopy and VASP☆29Updated 3 years ago
- Quick tools for materials chemistry☆17Updated last year
- Unfolding the band structure of a supercell obtained with VASP☆25Updated 2 years ago
- Materials Science Scripts☆13Updated 2 months ago
- Python scripts to postprocess Quantum Espresso calclations.☆18Updated 5 years ago
- ☆19Updated 5 months ago
- Vizualisation of Atomic Contributions to Phonon Modes☆12Updated 6 months ago
- ☆20Updated last year
- Tutorials of codes such as VASP, Quantum Espresso and Lammps☆13Updated last month