MineralsCloud / phqLinks
phq: a Fortran code to compute phonon quasiparticle properties and dispersions
☆14Updated 6 years ago
Alternatives and similar repositories for phq
Users that are interested in phq are comparing it to the libraries listed below
Sorting:
- WanTiBEXOS code repository☆16Updated last month
- Interfacial Phonon code☆28Updated 3 years ago
- A collection of codes to compute dynamics and response quantities from Wannier90 output☆15Updated 3 months ago
- A python package of utils for DFT, Tight binding, etc.☆16Updated 2 months ago
- ☆12Updated 7 years ago
- SPMS table of pseudopotentials☆21Updated 3 years ago
- create wavefunction file from selected spin, kpoint and band index in VASP wavecar☆14Updated 4 years ago
- Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory☆23Updated 5 years ago
- Extension of almaBTE's Monte Carlo code beyond the relaxation-time approximation.☆10Updated 2 years ago
- Unfolding the band structure of a supercell obtained with VASP☆25Updated 3 years ago
- Automatic construction of wannier functions for any 3D transition metal based system with or without SOC☆15Updated 3 years ago
- Set of codes to extract force constants from force-displacements data, calculate phonon dispersion (FOCEX) and thermal transport properti…☆18Updated last month
- Calculating electron-phonon couplings with DFTB.☆10Updated last month
- Julia codes to play with Phonons☆24Updated 7 years ago
- Python scripts to postprocess Quantum Espresso calclations.☆20Updated 5 years ago
- Tutorial for Wannier2022☆16Updated 2 months ago
- Construct phonon tight-binding model and calculate its topological properties☆27Updated 6 years ago
- bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…☆14Updated 5 months ago
- Visualizations☆14Updated 4 years ago
- Python version ofthe BandUP code☆28Updated last year
- python workflow for GW-BSE calculation☆31Updated 2 years ago
- ☆21Updated last year
- A phonon irreducible representations calculator☆22Updated last year
- AICON2: A program for calculating transport properties quickly and accurately☆15Updated 2 years ago
- Tools required to calculate the SLME of materials☆13Updated last year
- Corrections for formation energy and eigenvalues for charged defect simulations☆14Updated 2 years ago
- A Fortran90 program for unfolding phonon dispersions☆11Updated 5 years ago
- Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.☆27Updated 3 weeks ago
- ☆12Updated 5 years ago
- D3Q + thermal2☆26Updated 2 months ago