AdityaRoy-1996 / Phonopy_VESTA
Export Eigenvectors from Phonopy format to VESTA
☆38Updated last month
Alternatives and similar repositories for Phonopy_VESTA:
Users that are interested in Phonopy_VESTA are comparing it to the libraries listed below
- Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP☆31Updated 10 months ago
- Visualize vibrational modes from VASP calculations☆37Updated last month
- A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…☆51Updated this week
- Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP☆22Updated 4 years ago
- KPROJ: A Band Unfolding Program☆38Updated 2 weeks ago
- A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.☆31Updated 2 years ago
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆54Updated 2 years ago
- In analogy with thirdorder.py in ShengBTE, Fourthorder.py is developed to calculate fourth-order interatomic force-constants (4th-IFCs). …☆27Updated last year
- Allen-Feldman thermal conductivity compatible to GULP implementation☆18Updated last week
- This API_Phonons is a set of python scripts and functions for interfacing different packages for phonon modeling.☆27Updated last month
- An extension module to ShengBTE for computing four-phonon scattering rates and thermal conductivity☆64Updated 10 months ago
- Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.☆55Updated this week
- Occupation matrix control modification VASP☆44Updated 5 years ago
- VASP Convergence Testing (for Energy & Dielectric Constants)☆52Updated 10 months ago
- ☆18Updated 5 years ago
- Tools for Phono(3)py power users.☆32Updated last year
- some toolkits for VASP☆28Updated 3 years ago
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆41Updated 9 months ago
- Automatic search for the most stable magnetic state of a given structure☆21Updated last year
- Interfacial Phonon code☆25Updated 2 years ago
- DFT post processing tools☆23Updated 6 months ago
- Wavelike and Particlelike Phonon Transport (WPPT) Solver☆26Updated 2 months ago
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆78Updated last year
- Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code☆67Updated 5 months ago
- Concentric Approximation - Non-adiabatic Coupling☆22Updated this week
- Ferroelectric/Ferroelastic domain wall builder☆17Updated 4 months ago
- Implementation for computing nonradiative recombination rates in semiconductors☆42Updated 4 months ago
- A VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization☆34Updated 5 months ago
- Converts the VASP WAVECAR to UNK files for wannier90.☆22Updated 4 years ago
- Dealing with slabs for first principles calculations of surfaces☆61Updated last year