to solve the aBR decomposition online for an unconventional material or obstructed atomic insulator (OAI). "Unconventional materials", Sci. Bul. 67(6), 598-608 (2022).
☆13Jul 28, 2022Updated 4 years ago
Alternatives and similar repositories for UnconvMat
Users that are interested in UnconvMat are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Restructure single parabolic band(RSPB) model used for thermoelectricity☆11Jul 25, 2025Updated last year
- Building tight-binding model for generic twisted graphene☆13Aug 30, 2021Updated 5 years ago
- A VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization☆48Aug 24, 2024Updated 2 years ago
- A tool for calculating topological invariants.☆98Feb 20, 2025Updated last year
- Collective atomic modulation analysis with irreducible space-group representation☆18Updated this week
- 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 package for quickly constructing k·p models of magnetic and non-magnetic crystals☆20Aug 25, 2026Updated 2 months ago
- An automatic workflow to search for topological materials in 1651 magnetic space groups. Ref: J. Gao, et al. "Magnetic band representatio…☆22Jul 16, 2025Updated last year
- IRVSP: to obtain irreducible representations of electronic states in the VASP, Comput. Phys. Comm. 261, 107760 (2021). https://doi.org/10…☆137May 26, 2026Updated 5 months ago
- A python utilities to handle with atomic structures and interfacing with common formats (xyz and quantum-espresso).☆28Jul 22, 2026Updated 3 months ago
- Official Repository of the Optados code☆25Nov 14, 2025Updated 11 months ago
- A package for tight-binding model of magnetic and non-magnetic materials☆66Sep 7, 2026Updated last month
- Postprocess the phonon spectra, phonon dos, atomic participation rate, mean square displacement, scattering rate, and energy cumulative …☆12Feb 27, 2021Updated 5 years ago
- A phonon irreducible representations calculator☆24Apr 11, 2024Updated 2 years ago
- extract third order force constants from TDEP output☆10Jun 22, 2020Updated 6 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- to obtain parameters of kp model and Lande g-factors directly from the VASP wavefunctions. Ref: Zhang et al., Chin. Phys. Lett. 40, 1271…☆37Jun 10, 2025Updated last year
- Demonstrate basic but typical physical properties of symmetry-protected non-trivial states in single-particle or mean-field level.☆14Mar 11, 2021Updated 5 years ago
- Computation of lattice Green function for dislocation topologies☆12Dec 21, 2018Updated 7 years ago
- A mathematica package for irreducible representations of space group☆59Apr 30, 2025Updated last year
- Generate isosurface from density data☆15Sep 7, 2026Updated last month
- Symmetry analysis and symmetrize in Wannier orbitals☆46Oct 16, 2026Updated 2 weeks ago
- Calculate the planar averaged electrostatic potential for the density functional theory code VASP (Version 5 compatible)☆20Sep 10, 2017Updated 9 years ago
- Fermi surface generation, analysis and visualisation.☆102Oct 1, 2026Updated 3 weeks ago
- Phonon dynamical structure factor calculation☆13Aug 11, 2023Updated 3 years 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.
- ☆32Dec 27, 2024Updated last year
- ☆83Oct 18, 2026Updated last week
- Code for the Selected Columns of the Density Matrix suite of algorithms☆14Dec 7, 2018Updated 7 years ago
- WannierTools: An open-source software package for novel topological materials. Full documentation:☆343Jun 9, 2025Updated last year
- Esercitazioni DFT con quantum espresso☆15Jun 4, 2024Updated 2 years ago
- Converts the VASP WAVECAR to UNK files for wannier90.☆25Jun 9, 2020Updated 6 years ago
- Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code☆97Oct 9, 2026Updated 3 weeks ago
- Sky-MoCa Skyrmion - Monte Carlo: Simulated annealing for a 3D spin lattice in Julia☆14Jul 4, 2019Updated 7 years ago
- Export Eigenvectors from Phonopy format to VESTA☆57Dec 24, 2024Updated last year
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- ☆15Apr 1, 2011Updated 15 years ago
- Wannier-orbital Basis Suite Towards Electronic-Structure Reconstruction☆16Sep 5, 2023Updated 3 years ago
- Construct phonon tight-binding model and calculate its topological properties☆27Sep 15, 2019Updated 7 years ago
- Using different methods to calculate Chern number for Haldane model with disorder☆22Aug 27, 2018Updated 8 years ago
- Builds 2D heterostructures via coincidence lattice theory.☆16Nov 21, 2023Updated 2 years ago
- A tool for calculating the general form of a k.p Hamiltonian with a given symmetry.☆23May 8, 2023Updated 3 years ago
- A play ground for PythTb, Kwant, Pybinding and Wannier90 👾, and MORE☆15Mar 25, 2019Updated 7 years ago