139 citations · 392 across the 12 of their papers we have counts for
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cond-mat.stat-mech2018★ 72 cited
KineCluE: a Kinetic Cluster Expansion code to compute transport coefficients beyond the dilute limit
T. Schuler, L. Messina, M Nastar
This paper introduces the KineCluE code that implements the self-consistent mean-field theory for clusters of finite size. Transport coefficients are obtained as a sum over cluster…
physics.comp-ph2018★ 8 cited
Smart energy models for atomistic simulations using a DFT-driven multifidelity approach
Luca Messina, Alessio Quaglino, Alexandra Goryaeva +5
The reliability of atomistic simulations depends on the quality of the underlying energy models providing the source of physical information, for instance for the calculation of mi…