Official repository of the Wannier90 code
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Nov 14, 2024 - Roff
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wannier-functions
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A playground for Wannier functions
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Oct 16, 2024 - Julia
BinPo: A code for electronic properties of 2D electron systems
python physics band-structure tight-binding condensed-matter spin-orbit-coupling fermi-surface wannier-functions two-dimensional-electron-systems schrodinger-poisson-equations rashba-effect complex-oxides strontium-titanate
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Sep 1, 2022 - Python
(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.
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Feb 6, 2024 - Fortran
loss optimization under unitary constraint
machine-learning quantum-chemistry optimization-methods materials-science optimization-algorithms loss-functions wannier-functions
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Nov 26, 2024 - Julia
A lightweight Python package for calculating well-established descriptors of chemical bonding from Wannier functions.
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Dec 22, 2024 - Python
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