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How to verify the precision of density-functional-theory implementations via reproducible and universal workflows

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Magnons from time-dependent density-functional perturbation theory and nonempirical Hubbard functionals

Nicola Marzari, Luca Binci

Spin excitations play a fundamental role in understanding magnetic properties of materials, and have significant technological implications for magnonic devices. However, accurately modeling these in transition-metal and rare-earth compounds remains a form ...

2025

Pioneering non-thermal plasma as a defect passivator: a new Frontier in ambient metal halide perovskite synthesis

Mohammad Khaja Nazeeruddin

Growing energy demands make cost-effective, high-performance perovskite solar cells (PSCs) desirable. However, their commercial applications are limited due to defect formation and instability. Passivation technologies help enhance their favorable traits. ...

Royal Society of Chemistry2024

Weyl spin-momentum locking in a chiral topological semimetal

Jan Hugo Dil, Eduardo Bonini Guedes

Spin-orbit coupling in noncentrosymmetric crystals leads to spin-momentum locking - a directional relationship between an electron's spin angular momentum and its linear momentum. Isotropic orthogonal Rashba spin-momentum locking has been studied for decad ...

NATURE PORTFOLIO2024

Test of lepton flavor universality in B± → K± μ+μ- and B± → K± e+ e- decays in proton-proton collisions at √s=13 TeV

Jan Steggemann, Konstantin Androsov, Anna Mascellani, Joanna Malgorzata Wanczyk

A test of lepton flavor universality in B-+/- -> K +/- mu(+) mu(-) and B-+/- -> (K)+/- e(+) e(-) decays, as well as a measurement of differential and integrated branching fractions of a nonresonant B-+/- -> K-+/- mu(+)mu(-) decay are presented. The analysi ...

IOP Publishing Ltd2024