Fermi surface generation, analysis and visualisation.
☆102Sep 4, 2026Updated 2 weeks ago
Alternatives and similar repositories for IFermi
Users that are interested in IFermi are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Converts the VASP WAVECAR to UNK files for wannier90.☆25Jun 9, 2020Updated 6 years ago
- A collection of python scripts that deal with VASP outpts, e.g. WAVECAR, POTCAR etc.☆292Apr 27, 2026Updated 4 months ago
- Dealing with slabs for first principles calculations of surfaces☆70Sep 17, 2023Updated 3 years ago
- Python Package for Band Unfolding of Plane-wave Based First-Principles Calculations☆29Jul 27, 2026Updated last month
- ☆10Sep 26, 2025Updated 11 months ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- An interface for ELK-Wannier90 calculations☆16Oct 13, 2020Updated 5 years ago
- Code to convert DFPT modes in OUTCAR files to VESTA images☆27Aug 14, 2022Updated 4 years ago
- IRVSP: to obtain irreducible representations of electronic states in the VASP, Comput. Phys. Comm. 261, 107760 (2021). https://doi.org/10…☆137May 26, 2026Updated 3 months ago
- Automatic construction of wannier functions for any 3D transition metal based system with or without SOC☆15Feb 18, 2022Updated 4 years ago
- Gaussian and Lorentzian smearing of simulated spectra☆46Updated this week
- solid_dmft is a versatile python wrapper to perform DFT+DMFT calculations utilizing the TRIQS software library.☆43Aug 5, 2026Updated last month
- Band structure unfolding made easy!☆68Jul 6, 2026Updated 2 months ago
- Advanced tool for Wannier interpolation and integration of k-space integrals☆123Updated this week
- Heavyweight plotting tools for ab initio calculations☆260Sep 3, 2026Updated 2 weeks ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Python package for calculating thermodynamic potentials from first-principles calculations☆14Updated this week
- Electronic transport properties from first-principles calculations☆163Aug 31, 2026Updated 2 weeks ago
- An open-source framework to treat strongly correlated materials using DMFT.☆64Jun 12, 2026Updated 3 months ago
- A lightweight python package for reading and writing VASP ML_AB files☆46Feb 24, 2025Updated last year
- Restructure single parabolic band(RSPB) model used for thermoelectricity☆11Jul 25, 2025Updated last year
- Tight-binding parameter fitting package (TBFIT) for Slater-Koster method☆33Sep 11, 2022Updated 4 years ago
- a python package for computing magnetic interaction parameters☆102Updated this week
- Natural Bond Orbital algorithm to handle systems characterized by periodic symmetry☆21Dec 5, 2021Updated 4 years ago
- BandUP: Band Unfolding code for Plane-wave based calculations☆107Apr 13, 2021Updated 5 years ago
- Simple, predictable pricing with DigitalOcean hosting • AdAlways know what you'll pay with monthly caps and flat pricing. Enterprise-grade infrastructure trusted by 600k+ customers.
- Parallel C/Python package for numerical analysis of PAW DFT wavefunctions☆36Nov 2, 2021Updated 4 years ago
- An updated version of the VASP2WANNIER90v2 interface☆111Sep 19, 2023Updated 3 years ago
- Defect structure-searching employing chemically-guided bond distortions☆131Jul 17, 2026Updated 2 months ago
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆86May 11, 2026Updated 4 months ago
- Calculate the required k-point density from the input geometry for periodic quantum chemistry calculations☆23Nov 8, 2022Updated 3 years ago
- py-sc-fermi is a materials modelling code for calculating self-consistent Fermi energies and defect concentrations under thermodynamic eq…☆34Sep 11, 2026Updated last week
- Wannier-orbital Basis Suite Towards Electronic-Structure Reconstruction☆16Sep 5, 2023Updated 3 years ago
- ☆14Nov 16, 2022Updated 3 years ago
- Python package to analyse the structural dynamics of perovskites☆57Aug 15, 2026Updated last month
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- A VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization☆48Aug 24, 2024Updated 2 years ago
- A Python library for electronic structure pre/post-processing☆224Updated this week
- Tutorial for Wannier2022☆18Apr 6, 2026Updated 5 months ago
- ⚗️ matador is an aggregator, manipulator and runner of first-principles calculations, written with a bent towards battery 🔋 electrode ma…☆35Sep 1, 2026Updated 2 weeks ago
- Code to analyse thermodynamics of alloys through the generalized quasi-chemical approximation (GQCA)☆15Oct 6, 2019Updated 6 years ago
- Add on-site SOC to Wannier Hamiltonian.☆18Mar 24, 2021Updated 5 years ago
- An open-source framework to treat strongly correlated materials using DMFT.☆34Aug 7, 2026Updated last month