spglib / spinspgLinks
Python package for detecting spin space group on top of spglib
☆18Updated 3 weeks ago
Alternatives and similar repositories for spinspg
Users that are interested in spinspg are comparing it to the libraries listed below
Sorting:
- Band structure unfolding made easy!☆57Updated last week
- Examples for the TB2J code☆17Updated 2 weeks ago
- Interfacial Phonon code☆28Updated 3 years ago
- Utility for applying the distortion symmetry method.☆28Updated last year
- py-sc-fermi is a materials modelling code for calculating self-consistent Fermi energies and defect concentrations under thermodynamic eq…☆29Updated 4 months ago
- TDEP Tutorials☆32Updated 4 months ago
- Compressive sensing lattice dynamics☆31Updated 8 months ago
- quick analysis of vasp calculation☆38Updated last year
- MAISE Module for Ab Initio Structure Evolution (MAISE)☆35Updated last month
- A for finding optimized SQS structures tool written in C++☆51Updated 3 weeks ago
- The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).☆67Updated last week
- Collective atomic modulation analysis with irreducible space-group representation☆18Updated last week
- Use 3D visualization software Mayavi to visualize VASP POSCAR file.☆34Updated 2 years ago
- A computational framework to automate point defect calculations☆38Updated 7 years ago
- bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…☆14Updated 2 months ago
- Some tutorial-style examples for validating machine-learned interatomic potentials☆34Updated last year
- Phonons from ML force fields☆23Updated 3 months ago
- ☆22Updated 2 years ago
- ☆20Updated 10 months ago
- Tools for Phono(3)py power users.☆34Updated 2 years ago
- Unfolding the band structure of a supercell obtained with VASP☆25Updated 2 years ago
- Visualizations☆14Updated 3 years ago
- python workflow for GW-BSE calculation☆30Updated 2 years ago
- ☆27Updated 9 months ago
- Gaussian and Lorentzian smearing of simulated spectra☆42Updated last year
- Python scripts to postprocess Quantum Espresso calclations.☆19Updated 5 years ago
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆47Updated last year
- Bash and Python scripts to perform simple post-processing and analyses on VASP calculation outputs.☆25Updated 7 years ago
- DensityTool post-processing program for VASP☆31Updated last year
- A lightweight python package for reading and writing VASP ML_AB files☆40Updated 8 months ago