DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages
☆64Mar 11, 2022Updated 4 years ago
Alternatives and similar repositories for DMFTwDFT
Users that are interested in DMFTwDFT 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 VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization☆47Aug 24, 2024Updated last year
- A framework to treat strongly correlated materials using beyond-DFT methods☆25Dec 1, 2020Updated 5 years ago
- Full-potential Linearized Augmented Plane Wave code FLEUR: All-electron DFT (repo mirror)☆19May 13, 2026Updated last week
- A repository hosting materials used during Wannier-related tutorials and schools☆45Jun 9, 2024Updated last year
- WannierTools: An open-source software package for novel topological materials. Full documentation:☆329Jun 9, 2025Updated 11 months ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- A continuous-time hybridization-expansion Monte Carlo code for calculating n-particle Green's functions of the Anderson impurity model an…☆58Jan 21, 2026Updated 3 months ago
- Fermi surface generation, analysis and visualisation.☆101May 2, 2026Updated 2 weeks ago
- Python version ofthe BandUP code☆28Oct 14, 2024Updated last year
- Massively Parallel Lanczos based solver for quantum impurity problems, published in Computer Physics Communication (see link)☆18May 21, 2025Updated 11 months ago
- solid_dmft is a versatile python wrapper to perform DFT+DMFT calculations utilizing the TRIQS software library.☆42Mar 27, 2026Updated last month
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆56Jan 26, 2026Updated 3 months ago
- Advanced tool for Wannier interpolation and integration of k-space integrals☆117Apr 22, 2026Updated 3 weeks ago
- Electronic transport properties from first-principles calculations☆160Updated this week
- Calculate 3rd order elastic constant.☆13Mar 23, 2025Updated last year
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- A software to calculate thermal conductivity quickly and accurately☆38Feb 20, 2020Updated 6 years ago
- A Python library for electronic structure pre/post-processing☆213Jan 29, 2026Updated 3 months ago
- A python package to compute zero-field-splitting tensors for molecules and spin quantum bits in semiconductors.☆14Mar 30, 2020Updated 6 years ago
- Symmetry analysis and symmetrize in Wannier orbitals☆44Apr 26, 2024Updated 2 years ago
- Reference implementation of GW☆13Jul 22, 2019Updated 6 years ago
- DMFT software for CORrelated Electrons☆50Nov 6, 2025Updated 6 months ago
- Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code☆84Aug 3, 2025Updated 9 months ago
- A mirror of https://gitlab.kwant-project.org/qt/qsymm☆41Mar 20, 2026Updated 2 months ago
- Draft for my book about implementing density functional theory☆20Mar 18, 2026Updated 2 months ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- A package for quickly constructing k·p models of magnetic and non-magnetic crystals☆20Jan 18, 2025Updated last year
- python workflow for GW-BSE calculation☆31Jun 16, 2023Updated 2 years ago
- WEST code☆33Mar 3, 2026Updated 2 months ago
- 2014: Variational Monte Carlo for the harmonic oscillator, helium, hydrogen and H2 - IPython notebook and FORTRAN90☆13Jun 23, 2016Updated 9 years ago
- Materials Science Scripts☆13Aug 28, 2025Updated 8 months ago
- Interacting quantum impurity solver toolkit☆42Sep 4, 2025Updated 8 months ago
- IRVSP: to obtain irreducible representations of electronic states in the VASP, Comput. Phys. Comm. 261, 107760 (2021). https://doi.org/10…☆133Oct 23, 2022Updated 3 years ago
- Thermo_pw is a driver of quantum-ESPRESSO routines for the automatic computation of ab-initio material properties.☆62Updated this week
- VASP - Localized Orbital Locator + Electron Localizability Indicator☆18Dec 18, 2022Updated 3 years ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- Code to convert DFPT modes in OUTCAR files to VESTA images☆27Aug 14, 2022Updated 3 years ago
- Julia code for the computation of Wannier functions☆23Nov 30, 2018Updated 7 years ago
- Scientific Python package for solving Slater Koster tight-binding topological hamiltonian☆58Mar 12, 2026Updated 2 months ago
- MAterials Simulation Toolkit for use with pymatgen☆17Feb 21, 2024Updated 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…☆15May 13, 2026Updated last week
- Coupled-Channels optical model and Hauser-Feshbach theory for nuclear reactions☆13Apr 20, 2026Updated last month
- A versatile Gutzwiller solver to optimize the single Slater determinant and local many-body degrees of freedom simultaneously within the …☆16Mar 19, 2020Updated 6 years ago