hungpham2017 / mcuLinks
Modeling and Crystallographic Utilities
☆50Updated 2 years ago
Alternatives and similar repositories for mcu
Users that are interested in mcu are comparing it to the libraries listed below
Sorting:
- Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code☆69Updated 9 months ago
- Converts the VASP WAVECAR to UNK files for wannier90.☆23Updated 4 years ago
- ☆66Updated 3 weeks ago
- Band unfolding for phonons☆54Updated 7 months ago
- DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages☆57Updated 3 years ago
- ☆28Updated 2 weeks ago
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆80Updated 2 weeks ago
- a python package for computing magnetic interaction parameters☆79Updated this week
- VASP subtool to draw Fermi-Surface; creates input file for Xcrysden☆37Updated 2 years ago
- A Wannier90 python interface for VASP and PySCF☆38Updated last year
- Scientific Python package for solving Slater Koster tight-binding topological hamiltonian☆52Updated last year
- A collection of examples for running different types of VASP calculations.☆30Updated 8 years ago
- Tutorials for the sisl-TBtrans-TranSiesta suite☆43Updated 6 months ago
- Band structure unfolding made easy!☆53Updated this week
- KPROJ: A Band Unfolding Program☆44Updated 3 months ago
- Symmetry analysis and symmetrize in Wannier orbitals☆41Updated last year
- A tool for creating and manipulating tight-binding models.☆39Updated 2 months ago
- A VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization☆40Updated 9 months ago
- to compute kp parameters and Lande g-factors directly from the VASP wavefunctions. Ref: Zhang et al., Chin. Phys. Lett. 40, 127101 (2023…☆21Updated last year
- A repository hosting materials used during Wannier-related tutorials and schools☆41Updated 11 months ago
- Julia package to compute trap-assisted electron and hole capture in semiconductors☆56Updated last month
- Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP☆32Updated last year
- Parallel C/Python package for numerical analysis of PAW DFT wavefunctions☆33Updated 3 years ago
- DensityTool post-processing program for VASP☆31Updated last year
- Implementation for computing nonradiative recombination rates in semiconductors☆48Updated 7 months ago
- python workflow for GW-BSE calculation☆28Updated last year
- The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).☆61Updated 6 months ago
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆42Updated last year
- Export Eigenvectors from Phonopy format to VESTA☆43Updated 5 months ago
- Ab initio tight binding simuation package☆27Updated last month