goodluck1982 / MSGCorep
An offline corepresentation database and tool set for 1651 magnetic space groups.
☆13Updated last year
Alternatives and similar repositories for MSGCorep:
Users that are interested in MSGCorep are comparing it to the libraries listed below
- A phonon irreducible representations calculator☆18Updated 10 months ago
- solid_dmft is a versatile python wrapper to perform DFT+DMFT calculations utilizing the TRIQS software library.☆33Updated 3 weeks ago
- Julia codes to play with Phonons☆23Updated 6 years ago
- a python package for computing magnetic interaction parameters☆74Updated 2 weeks ago
- Tutorials for the sisl-TBtrans-TranSiesta suite☆40Updated 3 months ago
- Scientific Python package for solving Slater Koster tight-binding topological hamiltonian☆48Updated last year
- Restore the symmetry of Wannier Hamiltonian generated by Wannier90☆27Updated 3 years ago
- Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory☆19Updated 4 years ago
- Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.☆24Updated 11 months ago
- ☆20Updated 3 years ago
- Julia package to compute trap-assisted electron and hole capture in semiconductors☆56Updated 2 weeks ago
- ☆26Updated 2 years ago
- A collection of advanced automated workflows to compute Wannier functions using AiiDA and the Wannier90 code☆17Updated last week
- ☆63Updated 2 weeks ago
- DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages☆56Updated 2 years ago
- ☆20Updated last year
- Tight binding molecular dynamics code to model carbon structures (linear carbon chains, fullerenes, graphene, etc.)☆10Updated 7 years ago
- ☆15Updated 6 months ago
- A mathematica package for irreducible representations of space group☆53Updated 7 months ago
- Symmetry analysis and symmetrize in Wannier orbitals☆40Updated 9 months ago
- A mirror of https://gitlab.kwant-project.org/qt/qsymm☆40Updated 2 weeks ago
- Utility to construct and operate on Hamiltonians from the Projections of DFT wfc on Atomic Orbital bases (PAO)☆38Updated last week
- Utility to construct and operate on Hamiltonians from the Projections of DFT wave functions on Atomic Orbital bases (PAO)☆22Updated last year
- Using different methods to calculate Chern number for Haldane model with disorder☆22Updated 6 years ago
- to compute kp parameters and Lande g-factors directly from the VASP wavefunctions. Ref: Zhang et al., Chin. Phys. Lett. 40, 127101 (2023…☆20Updated 8 months ago
- A repository hosting materials used during Wannier-related tutorials and schools☆40Updated 8 months ago
- D3Q + thermal2☆25Updated last week
- A software package for calculating the electronic structure and topological properties of the tight-binding (TB) model.☆20Updated 11 months ago
- A package for tight-binding model of magnetic and non-magnetic materials☆36Updated last month
- Advanced tool for Wannier interpolation and integration of k-space integrals☆96Updated 2 weeks ago