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PLUSU: A Python library to automate the calculation of Hubbard U via the linear response method. Streamline your DFT+U workflows with robust parameter extraction and self-consistent solvers.

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License: GNU GPLv3 PyPI

PLUSU

PLUSU is a Python toolkit for the first-principles determination of Hubbard $U$ parameters. It automates linear response calculations based on the density functional theory (DFT) approach pioneered by Cococcioni and de Gironcoli.

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