QE-CONVERSE: An open-source package for the Quantum ESPRESSO distribution to compute non-perturbatively orbital magnetization from first principles, including NMR chemical shifts and EPR parameters

Fuente: arXiv

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Bibliographic Details
Main Authors:	Fioccola, Simone, Giacomazzi, Luigi, Ceresoli, Davide, Martin-Samos, Layla, Hemerick, Anne, Richard, Nicolas
Format:	Preprint
Published:	2025
Subjects:	Materials Science Chemical Physics Computational Physics
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2503.04664