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physics.comp-ph2025
Tensor Networks for Liquids in Heterogeneous Systems
Zachary A. Johnson, Luciano G. Silvestri, Pierson Guthrey +1
Many-body correlations in strongly coupled liquids and plasmas are critical for many applications in nanofluids, biology, and fusion-related plasma physics, but their description i…
physics.comp-ph2025
Adaptive Equilibration of Molecular Dynamics Simulations
Luciano G. Silvestri, Zachary A. Johnson, Michael S. Murillo
We present a systematic framework for shortening and automating molecular dynamics equilibration through improved position initialization methods and uncertainty quantification ana…