Excitons in nonlinear optical responses: shift current in MoS2 and GeS monolayers
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Excitons in nonlinear optical responses: shift current in MoS2 and GeS monolayers
npj Computational Materials volume 11, Article number: 13 (2025) It is well-known that exciton effects are determinant to understanding…
Building unconventional magnetic phases on graphene by H atom manipulation: From altermagnets to Lieb ferrimagnets
https://doi.org/10.48550/arXiv.2501.12329 Engineering all fundamental magnetic phases within a single material platform would mark a…
CISS: understanding how chirality gives rise to magnetoconductance from DFT and group theory
It is generally accepted that spin-dependent electron transmission may appear in chiral systems, even…
EDUS: happy to be part of a project to simulate electron dynamics under electromagnetic radiation
We have presented, in collaboration with Antonio Picón’s group, a theoretical framework and its…
XATU: our code to calculate excitons from second principles is available now
We describe an efficient numerical implementation of the Bethe-Salpeter equation to obtain the excitonic…
Shift current: learn how to compute it from DFT and group theory
The bulk photovoltaic effect is an experimentally verified phenomenon by which a direct charge…