24 citations · 31 across the 2 of their papers we have counts for
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cond-mat.mtrl-sci2026
Hamiltonian learning reveals optoelectronic mechanisms across thermodynamic state space in soft semiconductors
Frederik Vonhoff, Jesper R. Pedersen, Frederico P. Delgado +5
Predicting optoelectronic response across thermodynamic state space requires coupling finite-temperature nuclear dynamics to electronic structure at scales where direct first-princ…
cond-mat.mtrl-sci2023★ 7 cited
Analytic elastic constants in molecular calculations: Finite strain, non-affine displacements, and many-body interatomic potentials
Jan Grießer, Lucas Frérot, Jonas A. Oldenstaedt +2
Elastic constants are among the most fundamental and important properties of solid materials, which is why they are routinely characterized in both experiments and simulations. Whi…