zjwang11 / VASP2KPLinks
to obtain parameters of kp model and Lande g-factors directly from the VASP wavefunctions. Ref: Zhang et al., Chin. Phys. Lett. 40, 127101 (2023) https://doi.org/10.1088/0256-307X/40/12/127101
☆29Updated 7 months ago
Alternatives and similar repositories for VASP2KP
Users that are interested in VASP2KP are comparing it to the libraries listed below
Sorting:
- Symmetry analysis and symmetrize in Wannier orbitals☆43Updated last year
- Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code☆78Updated 6 months ago
- IRVSP: to obtain irreducible representations of electronic states in the VASP, Comput. Phys. Comm. 261, 107760 (2021). https://doi.org/10…☆124Updated 3 years ago
- Public repository for the MATLAB code to compute band structures and other properties of twisted multilayer TMDs☆13Updated last year
- A Wannier90 python interface for VASP and PySCF☆41Updated 3 months ago
- Utility to construct and operate on Hamiltonians from the Projections of DFT wfc on Atomic Orbital bases (PAO)☆47Updated this week
- ☆73Updated last week
- Python code for twisting the 2D materials.☆30Updated 3 years ago
- DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages☆62Updated 3 years ago
- Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.☆27Updated last month
- KPROJ: A Band Unfolding Program☆47Updated 11 months ago
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆83Updated 8 months ago
- A VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization☆44Updated last year
- ☆68Updated 2 years ago
- Exchange parameters of Heisenberg model calculation via Green's function approach☆35Updated last year
- Spin Texture contains a C++-code as well as gnuplot scripts for generating and plotting spin textures☆23Updated 3 years ago
- A repository hosting materials used during Wannier-related tutorials and schools☆45Updated last year
- Tight-binding parameter fitting package (TBFIT) for Slater-Koster method☆33Updated 3 years ago
- A self-adaptive spin-constraining scheme based on cDFT, operating as an extension to VASP☆34Updated last year
- Converts the VASP WAVECAR to UNK files for wannier90.☆24Updated 5 years ago
- Occupation matrix control modification VASP☆53Updated 6 years ago
- a python package for computing magnetic interaction parameters☆91Updated last week
- Band unfolding for phonons☆58Updated last year
- Prototype code of the tight-binding hamiltonian construction neural network model. Check the example_basic_method.py to construct a TB mo…☆31Updated 3 years ago
- Python version ofthe BandUP code☆28Updated last year
- ☆31Updated 8 months ago
- Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP☆34Updated last year
- Tutorials for the sisl-TBtrans-TranSiesta suite☆44Updated 2 months ago
- A python based, MPI enabled, Monte-Carlo calculation of 2D system using Metropolis algorithm.☆37Updated 4 years ago
- Compressive sensing lattice dynamics☆32Updated 11 months ago