ccme-tmc / tmckitLinks
☆11Updated 5 years ago
Alternatives and similar repositories for tmckit
Users that are interested in tmckit are comparing it to the libraries listed below
Sorting:
- A collection of codes to compute dynamics and response quantities from Wannier90 output☆15Updated 3 months ago
- Correlation consistent Gaussian basis sets for solids☆25Updated 8 months ago
- WanTiBEXOS code repository☆16Updated last week
- SPMS table of pseudopotentials☆21Updated 3 years ago
- phq: a Fortran code to compute phonon quasiparticle properties and dispersions☆14Updated 6 years ago
- Quantum-electrodynamical Time-dependent Density Functional Theory Within Gaussian Atomic Basis☆14Updated 8 months ago
- Tutorial for Wannier2022☆16Updated 2 months ago
- Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.☆27Updated last month
- Simulation package for light-matter interaction.☆26Updated 9 months ago
- Python tools for mean-field Hubbard models☆26Updated 2 months ago
- Automatic construction of wannier functions for any 3D transition metal based system with or without SOC☆15Updated 3 years ago
- Density matrix embedding theory for periodic systems☆18Updated 4 years ago
- Utility to construct and operate on Hamiltonians from the Projections of DFT wave functions on Atomic Orbital bases (PAO)☆24Updated 2 years ago
- Unfolding the band structure of a supercell obtained with VASP☆25Updated 3 years ago
- Calculating electron-phonon couplings with DFTB.☆10Updated last week
- A python package of utils for DFT, Tight binding, etc.☆16Updated 2 months ago
- soliDMFT allows to perform charge self-consistent DFT+DMFT calculations by utilizing the triqs library and VASP.☆15Updated 3 years ago
- Crawford's Quantum Chemistry Exercises by Python approach☆32Updated 3 years ago
- python workflow for GW-BSE calculation☆31Updated 2 years ago
- Tutorial files for alamode☆13Updated last year
- Julia codes to play with Phonons☆24Updated 7 years ago
- ☆18Updated 2 months ago
- Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory☆23Updated 5 years ago
- DFT-D3 interface☆12Updated 2 years ago
- A play ground for PythTb, Kwant, Pybinding and Wannier90 👾, and MORE☆13Updated 6 years ago
- D3Q + thermal2☆26Updated 3 months ago
- A Fortran90 program for unfolding phonon dispersions☆11Updated 5 years ago
- create wavefunction file from selected spin, kpoint and band index in VASP wavecar☆14Updated 4 years ago
- WEST code☆31Updated 6 months ago
- ☆12Updated 8 years ago