Python package for Moiré EXciton calculations
☆13Aug 22, 2025Updated 6 months ago
Alternatives and similar repositories for PyMEX
Users that are interested in PyMEX are comparing it to the libraries listed below
Sorting:
- Public repository for the MATLAB code to compute band structures and other properties of twisted multilayer TMDs☆14Oct 31, 2024Updated last year
- python workflow for GW-BSE calculation☆31Jun 16, 2023Updated 2 years ago
- Python modules for electron–phonon models☆38Mar 13, 2026Updated last week
- Tools to help study and analyze the hot carrier generation and relaxation in plasmonic nanoparticles☆14Mar 1, 2026Updated 2 weeks ago
- Tutorials of codes such as VASP, Quantum Espresso and Lammps☆14Sep 13, 2025Updated 6 months ago
- Wannier-orbital Basis Suite Towards Electronic-Structure Reconstruction☆15Sep 5, 2023Updated 2 years ago
- Open-source first-principles computational toolkit for the efficient calculation of the strength of materials in 1D, 2D, and 3D materials…☆24Mar 29, 2025Updated 11 months ago
- ☆27Dec 16, 2024Updated last year
- Toolkit for visualizing phase stability and defects diagrams from DFT calculations of multicomponent materials.☆19Feb 20, 2024Updated 2 years ago
- Useful tools integrated for VASP/Wannier90 interface☆12Aug 31, 2022Updated 3 years ago
- Ferroelectric/Ferroelastic domain wall builder☆23Oct 17, 2024Updated last year
- Functions for easily making publication-quality figures with matplotlib.☆19Jan 20, 2024Updated 2 years ago
- ☆13Apr 12, 2023Updated 2 years ago
- Fine-tuning and distillation workflow for pretrained atomic potentials☆33Feb 11, 2026Updated last month
- ☆10Apr 3, 2023Updated 2 years ago
- bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…☆14Jul 30, 2025Updated 7 months ago
- Collective atomic modulation analysis with irreducible space-group representation☆18Mar 10, 2026Updated last week
- ☆31Dec 27, 2024Updated last year
- A high-performance framework for solving phonon and electron Boltzmann equations☆120Feb 28, 2026Updated 2 weeks ago
- An encyclopedia of numerical integrators. Experimental.☆17Feb 19, 2015Updated 11 years ago
- Concentric Approximation - Non-adiabatic Coupling☆25Mar 9, 2026Updated last week
- Add on-site SOC to Wannier Hamiltonian.☆18Mar 24, 2021Updated 4 years ago
- Data processing with Pandas course for the CM Hub at Imperial College☆15Jun 26, 2020Updated 5 years ago
- A software package for the high throughput construction, analysis, and featurization of two- and three-dimensional perovskite systems.☆31Sep 8, 2024Updated last year
- GPS plugin for NetKet (www.netket.org), introducing new models, optimizers and Fermionic functionality.☆18Nov 24, 2025Updated 3 months ago
- Julia package for studying electron-phonon coupling☆16Aug 18, 2025Updated 7 months ago
- Parallel C/Python package for numerical analysis of PAW DFT wavefunctions☆35Nov 2, 2021Updated 4 years ago
- A tool for computing k.p effective Hamiltonians with couplings to external fields including E, B, and epsilon, under given symmetry const…☆17Oct 14, 2022Updated 3 years ago
- The codes calculate energy spectrum, Chern number, particle partition entanglement and quantum metric of the band of the twisted bilayer …☆14Oct 27, 2024Updated last year
- Synology package for Omniedge☆18Feb 16, 2026Updated last month
- Band structure of bulk 2H-phase MoS2☆32Feb 15, 2022Updated 4 years ago
- Code for paper "Accelerating the discovery of materials for integrated/complex device"☆15Dec 20, 2023Updated 2 years ago
- Gaussian and Lorentzian smearing of simulated spectra☆44Oct 8, 2024Updated last year
- STM-2DScan.py is a postprocessing script for VASP code to generate STM images based on DFT-calculations. It firstly imports volumetric d…☆15Mar 30, 2020Updated 5 years ago
- Notes and tutorials on Density Functional Theory calculation using Quantum ESPRESSO.☆176Feb 15, 2026Updated last month
- Additional code for carrying out neural network modeling of hybrid DFT Hamiltonians (arxiv.org/abs/2302.08221)☆15Aug 29, 2024Updated last year
- Converts the VASP WAVECAR to UNK files for wannier90.☆24Jun 9, 2020Updated 5 years ago
- These are the slides associated with the GNN tutorial at the APS March Meeting☆21Mar 7, 2023Updated 3 years ago
- ☆21Aug 21, 2025Updated 6 months ago