JMSkelton / VASP-ExamplesLinks
A collection of examples for running different types of VASP calculations.
☆31Updated 9 years ago
Alternatives and similar repositories for VASP-Examples
Users that are interested in VASP-Examples are comparing it to the libraries listed below
Sorting:
- Occupation matrix control modification VASP☆53Updated 6 years ago
- Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP☆26Updated 5 years ago
- ☆31Updated 7 months ago
- Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP☆34Updated last year
- Extracts full elastic tensor from VASP OUTCAR and calculates some useful quantities☆26Updated 10 years ago
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆47Updated last year
- Band unfolding for phonons☆58Updated last year
- DensityTool post-processing program for VASP☆31Updated 2 years ago
- Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code☆78Updated 5 months ago
- some toolkits for VASP☆33Updated 4 years ago
- Interfacial Phonon code☆28Updated 3 years ago
- Modeling and Crystallographic Utilities☆51Updated 2 years ago
- DFT post processing tools☆26Updated last year
- A VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization☆44Updated last year
- Automatic search for the most stable magnetic state of a given structure☆25Updated 2 years ago
- VASP Convergence Testing (for Energy & Dielectric Constants)☆55Updated 2 months ago
- Visualize vibrational modes from VASP calculations☆45Updated 11 months ago
- quick analysis of vasp calculation☆38Updated last year
- Python Package to Calculate IR Intensities from the Dipole Approximation with Phonopy and VASP☆29Updated 4 years ago
- KPROJ: A Band Unfolding Program☆47Updated 11 months ago
- Construct phonon tight-binding model and calculate its topological properties☆27Updated 6 years ago
- Site-Occupation Disorder☆47Updated 9 months ago
- Wavelike and Particlelike Phonon Transport (WPPT) Solver☆28Updated last year
- A python based, MPI enabled, Monte-Carlo calculation of 2D system using Metropolis algorithm.☆37Updated 4 years ago
- Converts the VASP WAVECAR to UNK files for wannier90.☆24Updated 5 years ago
- Unfolding the band structure of a supercell obtained with VASP☆25Updated 3 years ago
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆55Updated 3 years ago
- Public repository for the MATLAB code to compute band structures and other properties of twisted multilayer TMDs☆13Updated last year
- Use 3D visualization software Mayavi to visualize VASP POSCAR file.☆35Updated 2 years ago
- Export Eigenvectors from Phonopy format to VESTA☆51Updated last year