Examples for the TB2J code
☆23Oct 9, 2025Updated last year
Alternatives and similar repositories for TB2J_examples
Users that are interested in TB2J_examples are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- a python package for computing magnetic interaction parameters☆105Oct 23, 2026Updated last week
- Resources and files for the advanced vampire workshop☆21Feb 6, 2026Updated 8 months ago
- Physics Informed Neural Network constrained to follow Gibbs Free Energy Equation☆20Jul 7, 2025Updated last year
- Vizualisation of Atomic Contributions to Phonon Modes☆13Nov 6, 2024Updated last year
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆51May 6, 2024Updated 2 years ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- Tools required to calculate the SLME of materials☆13Aug 28, 2024Updated 2 years ago
- Magnetic critical temperature Calculator☆18Apr 2, 2024Updated 2 years ago
- VASP - Localized Orbital Locator + Electron Localizability Indicator☆19Dec 18, 2022Updated 3 years ago
- Interfacial Phonon code☆30Jul 31, 2022Updated 4 years ago
- Automatic construction of wannier functions for any 3D transition metal based system with or without SOC☆15Feb 18, 2022Updated 4 years ago
- Atomistic simulator for magnetic materials☆160Updated this week
- Software to calculate magnetostriction coefficients and magnetoelastic constants☆22Aug 2, 2023Updated 3 years ago
- A self-adaptive spin-constraining scheme based on cDFT, operating as an extension to VASP☆37Nov 10, 2024Updated last year
- Python package for detecting spin space group on top of spglib☆25Sep 29, 2026Updated last month
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- Effective mass calculation with DFT☆16Jan 20, 2026Updated 9 months ago
- A software package for calculating the electronic structure and topological properties of the tight-binding (TB) model.☆25Apr 15, 2026Updated 6 months ago
- A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.☆193Sep 29, 2026Updated last month
- A shell script for calculating many interesting materials' parameters for photovoltaic applications, includng Band gap, polarisation☆23Nov 15, 2015Updated 10 years ago
- Python library for computing electron-phonon renormalizations from finite displacements☆11Jan 6, 2025Updated last year
- Postprocess the phonon spectra, phonon dos, atomic participation rate, mean square displacement, scattering rate, and energy cumulative …☆12Feb 27, 2021Updated 5 years ago
- Python program to evaluate off-resonance Raman activity using VASP code as the backend.☆190Jan 7, 2026Updated 9 months ago
- DefAP is a program developed to facilitate the exploration of a material's defect chemistry. A large number of features are provided and …☆22Apr 30, 2025Updated last year
- SpinW for Python☆16Updated this week
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- ☆13Feb 1, 2025Updated last year
- Utility to construct and operate on Hamiltonians from the Projections of DFT wfc on Atomic Orbital bases (PAO)☆56Updated this week
- mumax3 calculator.☆29Oct 19, 2026Updated last week
- Calculates self-consistent Fermi level given defect formation energies and the density of states.☆14Jan 15, 2020Updated 6 years ago
- Commands to run VASP jobs automatically. Pre-processing or post-processing☆10Jan 8, 2024Updated 2 years ago
- Semi-Supervised Anomaly Detection and Supervised Regression Approaches for Poisson's Ratio Prediction☆10May 7, 2025Updated last year
- ☆33May 20, 2025Updated last year
- A crystallographic visualizer for Python, compatible with files from common softwares like Quantum ESPRESSO, VASP, CP2K, etc.☆23Oct 15, 2024Updated 2 years ago
- Phonon dynamical structure factor calculation☆13Aug 11, 2023Updated 3 years ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- ☆10Jun 4, 2025Updated last year
- ☆32Dec 27, 2024Updated last year
- ☆10Sep 26, 2025Updated last year
- [ICLR 2026] Advancing Universal Deep Learning for Electronic-Structure Hamiltonian Prediction of Materials☆29Oct 18, 2026Updated last week
- A Python package for the creation of input files for CP2K, MACE-torch, MatterSim, SevenNet, ORB and Grace as well as the post-processing …☆27Sep 1, 2026Updated last month
- Exchange parameters of Heisenberg model calculation via Green's function approach☆35Feb 27, 2024Updated 2 years ago
- The pytorch implement of papar《AI-accelerated Discovery of Altermagnetic Materials》☆19Mar 19, 2026Updated 7 months ago