Wannier90: Maximally-localised Wannier functions for electronic-structure calculations (standalone code and Fortran/C/Python library)
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Updated
Oct 20, 2026 - Fortran
Wannier90: Maximally-localised Wannier functions for electronic-structure calculations (standalone code and Fortran/C/Python library)
A playground for Wannier functions
WannierNLQG is a Julia package for nonlinear responses and quantum-geometric quantities from Wannier tight-binding models.
WannierBSE-MATLAB is a high-performance computational suite engineered for solving the Bethe-Salpeter Equation (BSE) within the Wannier Tight-Binding (WTB) framework, specialized for 2D materials.
A lightweight Python package for calculating descriptors of chemical bonding and local electronic structure from Wannier functions.
BinPo: A code for electronic properties of 2D electron systems
(S)olid (s)tate (T)ask (C)onstructor: A high-perfomance computing oriented library to create integration and sampling tasks in the BZ of a crystal for k-dependent functions.
The data of Wannier function centre, spread and atomic coordinates are extracted from the output files processed by wannier90 and analyzed
Build and solve tight-binding models in Python: band structures, band topology (Chern, Z2, higher-order), quantum transport, Floquet and moiré systems, in vectorized NumPy/SciPy, for teaching and research
loss optimization under unitary constraint
AI-agent skill, verified toolkit, fully executed notebooks and an undergraduate course for PythTB 2.0 - tight-binding models, Berry phases, topological invariants
Modern Julia implementation of the complete Wannier90 tool chain: MLWFs, disentanglement, Wannier interpolation, and the full postw90 physics surface. Drop-in file-compatible; in-memory DFTK.jl bridge.
Implementation of ELF with wannier functions
Python tool to recenter polaron real-space distributions (wavefunctions/densities) in XSF files, particularly those generated from ab initio calculations using EPW. Fixes periodic boundary condition (PBC) wrapping artifacts for visualization by applying a circular shift (NumPy) to the DATAGRID_3D block.
A plugin for running Wannier90 calculations inside the AiiDAlab Quantum ESPRESSO App.
Electronic delocalization (δ) as a unifying descriptor for optical response, surface tension, and phase classification. Born in a Japanese bathhouse.
A plugin for running Wannier90 calculations inside the AiiDAlab Quantum ESPRESSO App.
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