MineralsCloud / pgmLinks
Calculate thermodynamic properties of matter using phonon gas model (PGM)
☆16Updated last year
Alternatives and similar repositories for pgm
Users that are interested in pgm are comparing it to the libraries listed below
Sorting:
- phq: a Fortran code to compute phonon quasiparticle properties and dispersions☆14Updated 5 years ago
- DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages☆58Updated 3 years ago
- Utility to construct and operate on Hamiltonians from the Projections of DFT wave functions on Atomic Orbital bases (PAO)☆24Updated last year
- Julia codes to play with Phonons☆24Updated 6 years ago
- A phonon irreducible representations calculator☆21Updated last year
- D3Q + thermal2☆26Updated last week
- Multiple Scattering Theory code for first principles calculations☆68Updated 3 weeks ago
- Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory☆23Updated 5 years ago
- Exchange parameters of Heisenberg model calculation via Green's function approach☆34Updated last year
- ☆12Updated last year
- A MATlab toolkit for LAttice DYnamics calculations based on empirical potentials☆10Updated 6 years ago
- Julia package to compute trap-assisted electron and hole capture in semiconductors☆56Updated this week
- a python package for computing magnetic interaction parameters☆80Updated this week
- Automatic construction of wannier functions for any 3D transition metal based system with or without SOC☆13Updated 3 years ago
- soliDMFT allows to perform charge self-consistent DFT+DMFT calculations by utilizing the triqs library and VASP.☆14Updated 3 years ago
- Tutorials for Quantum Espresso☆19Updated 2 years ago
- Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.☆26Updated last year
- Unfolding the band structure of a supercell obtained with VASP☆25Updated 2 years ago
- Scientific Python package for solving Slater Koster tight-binding topological hamiltonian☆53Updated last year
- The quasiparticle self-consistent GW method in the PMT method (LAPW+LMTO+Lo).☆31Updated last week
- Draft for my book about implementing density functional theory☆19Updated 4 months ago
- A repository hosting materials used during Wannier-related tutorials and schools☆41Updated last year
- ☆31Updated 2 months ago
- A library of Python modules for reading/writing and manipulating data associated with the wannier90 code☆14Updated 4 years ago
- Code for the Selected Columns of the Density Matrix suite of algorithms☆13Updated 6 years ago
- Python modules for electron–phonon models☆33Updated last month
- ☆29Updated last year
- SPMS table of pseudopotentials☆19Updated 2 years ago
- Full-potential Linearized Augmented Plane Wave code FLEUR: All-electron DFT (repo mirror)☆13Updated last week
- A tool for creating and manipulating tight-binding models.☆40Updated 5 months ago