QijingZheng / vaspwfc
create wavefunction file from selected spin, kpoint and band index in VASP wavecar
☆14Updated 3 years ago
Alternatives and similar repositories for vaspwfc:
Users that are interested in vaspwfc are comparing it to the libraries listed below
- Interfacial Phonon code☆26Updated 2 years ago
- Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP☆32Updated last year
- Python version ofthe BandUP code☆22Updated 6 months ago
- A python package of utils for DFT, Tight binding, etc.☆16Updated 10 months ago
- TDEP Tutorials☆29Updated last week
- DFT post processing tools☆24Updated 8 months ago
- ☆28Updated 2 years ago
- Converts the VASP WAVECAR to UNK files for wannier90.☆23Updated 4 years ago
- Builds 2D heterostructures via coincidence lattice theory.☆14Updated last year
- Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP☆23Updated 4 years ago
- Construct phonon tight-binding model and calculate its topological properties☆26Updated 5 years ago
- KPROJ: A Band Unfolding Program☆40Updated 2 months ago
- A play ground for PythTb, Kwant, Pybinding and Wannier90 👾, and MORE☆13Updated 6 years ago
- DensityTool post-processing program for VASP☆29Updated last year
- Python scripts to postprocess Quantum Espresso calclations.☆18Updated 5 years ago
- Spin Texture contains a C++-code as well as gnuplot scripts for generating and plotting spin textures☆21Updated 3 years ago
- Python scripts to calculate thermoelectric properties by using NEGF method in OpenMX code (http://www.openmx-square.org/).☆8Updated 6 years ago
- Unfolding the band structure of a supercell obtained with VASP☆25Updated 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…☆12Updated 3 years ago
- Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.☆24Updated last year
- Tutorial files for alamode☆12Updated 8 months ago
- Use 3D visualization software Mayavi to visualize VASP POSCAR file.☆30Updated last year
- python workflow for GW-BSE calculation☆27Updated last year
- WanTiBEXOS code repository☆12Updated 7 months ago
- A self-adaptive spin-constraining scheme based on cDFT, operating as an extension to VASP☆28Updated 5 months ago
- Tools for Phono(3)py power users.☆33Updated last year
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆41Updated 11 months ago
- ☆19Updated 4 months ago
- A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.☆33Updated 2 years ago
- extract third order force constants from TDEP output☆9Updated 4 years ago