Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP
☆35Apr 19, 2024Updated last year
Alternatives and similar repositories for VASP-plot-modes
Users that are interested in VASP-plot-modes are comparing it to the libraries listed below
Sorting:
- Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP☆26Aug 5, 2020Updated 5 years ago
- Visualize vibrational modes from VASP calculations☆45Jan 20, 2025Updated last year
- Python Package to Calculate IR Intensities from the Dipole Approximation with Phonopy and VASP☆29Aug 6, 2021Updated 4 years ago
- Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code☆79Aug 3, 2025Updated 6 months ago
- Automatic construction of wannier functions for any 3D transition metal based system with or without SOC☆15Feb 18, 2022Updated 4 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☆26Aug 14, 2022Updated 3 years ago
- Pymatgen-based script to collect structural descriptors from many atomic structures.☆13Nov 29, 2025Updated 3 months ago
- Magnetic critical temperature Calculator☆18Apr 2, 2024Updated last year
- A simple BASH script for extraction of infared intensities from DFPT calculation output by VASP code.☆26Apr 25, 2024Updated last year
- Calculating electron-phonon couplings with DFTB.☆10Feb 20, 2026Updated last week
- A python based, MPI enabled, Monte-Carlo calculation of 2D system using Metropolis algorithm.☆37Dec 26, 2021Updated 4 years ago
- Vizualisation of Atomic Contributions to Phonon Modes☆13Nov 6, 2024Updated last year
- Interfacial Phonon code☆28Jul 31, 2022Updated 3 years ago
- Band structure of bulk 2H-phase MoS2☆30Feb 15, 2022Updated 4 years ago
- Unfolding the band structure of a supercell obtained with VASP☆25Dec 28, 2022Updated 3 years ago
- Python program to evaluate off-resonance Raman activity using VASP code as the backend.☆179Jan 7, 2026Updated last month
- Script to generate distorted perovskite structures☆13Feb 10, 2024Updated 2 years ago
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆55Jan 26, 2026Updated last month
- Practical guide on how to use VASP☆26Jul 14, 2020Updated 5 years ago
- A collection of command line utilities for manipulating VASP input / outpu☆25Mar 4, 2022Updated 3 years ago
- Sample codes on computational solid state physics☆17Aug 15, 2020Updated 5 years ago
- Effective mass calculation with DFT☆16Jan 20, 2026Updated last month
- ☆12Jan 29, 2018Updated 8 years ago
- Visualizations☆14Jan 10, 2022Updated 4 years ago
- Automatic search for the most stable magnetic state of a given structure☆25Feb 17, 2026Updated last week
- A unified package for post-processing optical properties of point defects from first principles calculation.☆11Nov 10, 2025Updated 3 months ago
- Software to study polarization and topological properties of crystalline solids☆31Nov 15, 2024Updated last year
- Software to calculate magnetostriction coefficients and magnetoelastic constants☆19Aug 2, 2023Updated 2 years ago
- quick analysis of vasp calculation☆38Jun 7, 2024Updated last year
- Script library mainly about chemical physics.☆25Jun 15, 2025Updated 8 months ago
- ☆18Jan 27, 2020Updated 6 years ago
- ☆11Nov 20, 2025Updated 3 months 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
- VASP - Localized Orbital Locator + Electron Localizability Indicator☆18Dec 18, 2022Updated 3 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 …☆22Apr 30, 2025Updated 10 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 6 years ago
- ☆31Jul 26, 2020Updated 5 years ago
- Semi-empirical tight-binding computation of the electronic structure of semiconductors☆13Dec 31, 2025Updated 2 months ago