henriquemiranda / phononwebsiteLinks
Visualise lattice vibrations
☆102Updated 4 months ago
Alternatives and similar repositories for phononwebsite
Users that are interested in phononwebsite are comparing it to the libraries listed below
Sorting:
- Blender extensions for illustrations of phonons☆66Updated 6 years ago
- Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format☆84Updated 5 years ago
- The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).☆67Updated last week
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆81Updated 4 months ago
- ☆70Updated this week
- IRVSP: to obtain irreducible representations of electronic states in the VASP, Comput. Phys. Comm. 261, 107760 (2021). https://doi.org/10…☆119Updated 2 years ago
- BandUP: Band Unfolding code for Plane-wave based calculations☆103Updated 4 years ago
- Band unfolding for phonons☆57Updated 11 months ago
- Implementation for computing nonradiative recombination rates in semiconductors☆49Updated last week
- Phonon anharmonicity analysis from molecular dynamics☆133Updated last week
- a python package for computing magnetic interaction parameters☆85Updated this week
- The Temperature Dependent Effective Potentials (TDEP) code☆90Updated 3 weeks ago
- ☆58Updated 2 years ago
- LAMMPS interface for phonon calculations using phonopy☆88Updated last year
- Band structure unfolding made easy!☆57Updated last month
- Electronic transport properties from first-principles calculations☆156Updated this week
- band plot using python matplotlib☆175Updated 11 months ago
- A Python library for electronic structure pre/post-processing☆190Updated 2 weeks ago
- Effective Mass Calculator for Semiconductors☆110Updated 4 years ago
- A module to obtain and visualize k-vector coefficients and obtain band paths in the Brillouin zone of crystal structures☆142Updated 6 months ago
- A library of ultrasoft and PAW pseudopotentials☆84Updated 3 years ago
- An updated version of the VASP2WANNIER90v2 interface☆100Updated 2 years ago
- Occupation matrix control modification VASP☆50Updated 6 years ago
- The UppASD package is a simulation tool for atomistic spin dynamics and Monte Carlo simulations of Heisenberg spin systems.☆91Updated last week
- ab-initio nonadiabatic molecular dynamics program☆114Updated last year
- The program allows you to create regular structure supercell from cif file with partial occupancy and/or substitutions.☆103Updated last year
- A plugin to AiiDA for running simulations with VASP☆56Updated last week
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆47Updated last year
- A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…☆52Updated 5 months ago
- Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.☆63Updated last month