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20022025
most citedQuantum ESPRESSO: a modular and open-source software project for quantum simulations of materials

29.3k citations

Showing 2025Show all

16 papers · 1 filter

stat.ML2025

Generalization Error of -Divergence Stabilized Algorithms via Duality

Francisco Daunas, Iñaki Esnaola, Samir M. Perlaza +1

The solution to empirical risk minimization with -divergence regularization (ERM-DR) is extended to constrained optimization problems, establishing conditions for equivalence…

astro-ph.HE202517 cited

Survey of Radiative, Two-Temperature Magnetically Arrested Simulations of the Black Hole M87* I: Turbulent Electron Heating

Andrew Chael

We present a set of eleven two-temperature, radiative, general relativistic magnetohydrodynamic (2TGRRMHD) simulations of the black hole M87* in the magnetically arrested (MAD) sta…

cs.HC202552 cited

Fostering Appropriate Reliance on Large Language Models: The Role of Explanations, Sources, and Inconsistencies

Sunnie S. Y. Kim, Jennifer Wortman Vaughan, Q. Vera Liao +2

Large language models (LLMs) can produce erroneous responses that sound fluent and convincing, raising the risk that users will rely on these responses as if they were correct. Mit…

cond-mat.str-el202516 cited

Anomalous suppression of large-scale density fluctuations in classical and quantum spin liquids

Duyu Chen, Rhine Samajdar, Yang Jiao +1

Classical spin liquids (CSLs) are intriguing states of matter that do not exhibit long-range magnetic order and are characterized by an extensive ground-state degeneracy. Adding qu…

cond-mat.soft2025

Can one hear the shape of a crystal?

Haina Wang, Salvatore Torquato

Isospectrality is a general fundamental concept often involving whether various operators can have identical spectra, i.e., the same set of eigenvalues. In the context of the Lapla…

physics.chem-ph20252 cited

Graphs that predict exciton delocalization

Gregory D. Scholes

The field of molecular excitons and related supramolecular systems has largely focused on aggregates where nearest-neighbour couplings dominate. We propose that radically different…