DerekDardzinski / vaspvis
A highly flexible and customizable library for visualizing electronic structure data from VASP calculations.
☆37Updated 7 months ago
Alternatives and similar repositories for vaspvis:
Users that are interested in vaspvis are comparing it to the libraries listed below
- VASP Convergence Testing (for Energy & Dielectric Constants)☆54Updated last year
- Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP☆32Updated last year
- A self-adaptive spin-constraining scheme based on cDFT, operating as an extension to VASP☆28Updated 5 months ago
- quick analysis of vasp calculation☆35Updated 10 months ago
- Occupation matrix control modification VASP☆46Updated 5 years ago
- Extracts full elastic tensor from VASP OUTCAR and calculates some useful quantities☆26Updated 9 years ago
- ☆38Updated last year
- Automatic search for the most stable magnetic state of a given structure☆22Updated last year
- Band unfolding for phonons☆54Updated 6 months ago
- In analogy with thirdorder.py in ShengBTE, Fourthorder.py is developed to calculate fourth-order interatomic force-constants (4th-IFCs). …☆27Updated last year
- Source codes of the 1st VASPKIT-PAPATERA CUP Awards☆25Updated 5 years ago
- A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.☆34Updated 2 years ago
- Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.☆57Updated this week
- A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…☆52Updated last week
- 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 last year
- Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP☆23Updated 4 years ago
- ☆24Updated 2 weeks ago
- Visualize vibrational modes from VASP calculations☆41Updated 3 months ago
- Export Eigenvectors from Phonopy format to VESTA☆43Updated 4 months ago
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆54Updated 2 years ago
- some toolkits for VASP☆29Updated 4 years ago
- Band structure unfolding made easy!☆53Updated 2 weeks ago
- KPROJ: A Band Unfolding Program☆40Updated 3 months ago
- ☆50Updated 2 years ago
- ☆47Updated 2 weeks ago
- Ferroelectric/Ferroelastic domain wall builder☆17Updated 6 months ago
- XDATCAR_toolkit- A tool for convert XDATCAR to PDB☆60Updated 5 years ago
- Use 3D visualization software Mayavi to visualize VASP POSCAR file.☆30Updated last year
- DFT post processing tools☆24Updated 9 months ago