Visualize vibrational modes from VASP calculations
☆47Sep 29, 2026Updated last month
Alternatives and similar repositories for VaspVib2XSF
Users that are interested in VaspVib2XSF are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- create wavefunction file from selected spin, kpoint and band index in VASP wavecar☆14Jan 24, 2022Updated 4 years ago
- Use 3D visualization software Mayavi to visualize VASP POSCAR file.☆36Jun 26, 2023Updated 3 years ago
- Scripts for analyzing VASP output and preparing VASP input, especially for NEB calculations.☆20Feb 21, 2019Updated 7 years ago
- Code to convert DFPT modes in OUTCAR files to VESTA images☆27Aug 14, 2022Updated 4 years ago
- A collection of python scripts that deal with VASP outpts, e.g. WAVECAR, POTCAR etc.☆295Apr 27, 2026Updated 6 months ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- LaTeX/Tikz package. It provides several commands in order to draw atomic orbitals and molecular orbitals diagrams.☆15Nov 24, 2015Updated 10 years ago
- Blender extensions for illustrations of phonons☆71Mar 6, 2019Updated 7 years ago
- Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP☆32Aug 5, 2020Updated 6 years ago
- A tool for plotting phonon dispersion curves and phonon density of states.☆12Oct 1, 2020Updated 6 years ago
- quick analysis of vasp calculation☆38Jun 7, 2024Updated 2 years ago
- Script library mainly about chemical physics.☆26Jun 15, 2025Updated last year
- A computational framework to automate point defect calculations☆38Jun 5, 2018Updated 8 years ago
- A set of tools used for setup, analysis and post-processing of Density Functional Theory (DFT) calculations performed with the VASP packa…☆17Feb 5, 2018Updated 8 years ago
- Bash and Python scripts to perform simple post-processing and analyses on VASP calculation outputs.☆25Dec 10, 2017Updated 8 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- A collection of scripts to interpret/organize VASP output files☆24Oct 13, 2016Updated 10 years ago
- Implementation for computing nonradiative recombination rates in semiconductors☆56Nov 6, 2025Updated last year
- Export Eigenvectors from Phonopy format to VESTA☆57Dec 24, 2024Updated last year
- A collection of command line utilities for manipulating VASP input / outpu☆25Mar 4, 2022Updated 4 years ago
- Feynman's variational path-integral model for the Fröhlich polaron. Calculates temperature dependent polaron mobilities, and other polaro…☆36May 27, 2026Updated 5 months ago
- ☆49Jul 6, 2018Updated 8 years ago
- band plot using python matplotlib☆187Oct 30, 2024Updated 2 years ago
- A general parser for VASP☆16Updated this week
- ab-initio nonadiabatic molecular dynamics program☆129May 21, 2024Updated 2 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- VASP Convergence Testing (for Energy & Dielectric Constants)☆60May 23, 2026Updated 5 months ago
- Fix lattice component(s) during relaxation in VASP☆148Nov 27, 2025Updated 11 months ago
- ☆64Dec 5, 2024Updated last year
- Computes the dark matter-phonon scattering rate for a general scattering potential.☆13Mar 21, 2023Updated 3 years ago
- Concentric Approximation - Non-adiabatic Coupling☆28Mar 9, 2026Updated 7 months ago
- bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…☆17Aug 31, 2026Updated 2 months ago
- Ab initio simulator for thermal transport and lattice anharmonicity☆212Oct 30, 2026Updated last week
- A highly flexible and customizable library for visualizing electronic structure data from VASP calculations.☆45Sep 28, 2024Updated 2 years ago
- pymatgen-analysis-alloys is an add-on package for pymatgen intended to contain useful classes for describing alloy systems and analyzing …☆19Apr 24, 2026Updated 6 months ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Random symmetric initialization of crystals☆25Jan 6, 2018Updated 8 years ago
- A program to do spin correlated nonadiabatic molecular dynamics (NAMD).☆14Jun 5, 2025Updated last year
- Visualizations☆14Jan 10, 2022Updated 4 years ago
- A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.☆35Aug 19, 2022Updated 4 years ago
- A Python library for electronic structure pre/post-processing☆225Oct 10, 2026Updated 3 weeks ago
- A Python suite for manipulating VASP input and output☆54Mar 28, 2026Updated 7 months ago
- PyDEF 2.0 is a scientific program. It is a post-treatment software for ab-initio calculations performed with the Vienna Ab-Initio Simulat…☆17May 9, 2019Updated 7 years ago