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20162025
most citedPhase transitions of hybrid perovskites simulated by machine-learning force fields trained on-the-fly with Bayesian inference

646 citations · 945 across the 9 of their papers we have counts for

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cond-mat.mes-hall2024

Tuning Einstein Oscillator Frequencies of Cation Rattlers: A Molecular Dynamics Study of the Lattice Thermal Conductivity of CsPbBr

Jonathan Lahnsteiner, Max Rang, Menno Bokdam

The pure CsPbBr perovskite is an archetypal example of a strongly anharmonic crystal that poses a major challenge for computational methods to describe its thermodynamic proper…