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cond-mat.soft2022★ 17 cited
Slip and Stress From Low Strain-Rate Nonequilibrium Molecular Dynamics: The Transient-Time Correlation Function Technique
Luca Maffioli, Edward R. Smith, James P. Ewen +3
We derive the transient-time correlation function (TTCF) expression for the computation of phase variables of inhomogenous confined atomistic fluids undergoing boundary-driven plan…
cond-mat.soft2021
The Importance of Reference Frame for Pressure at the Liquid-Vapour Interface
Edward R. Smith
The local pressure tensor is non-unique, a fact which has generated confusion and debate in the seventy years since the seminal work by Irving Kirkwood. This non-uniqueness is norm…
cond-mat.soft2018
Moving Contact Lines: Linking Molecular Dynamics and Continuum-Scale Modeling
E. R. Smith, P. E. Theodorakis, R. V. Craster +1
Despite decades of research, the modeling of moving contact lines has remained a formidable challenge in fluid dynamics whose resolution will impact numerous industrial, biological…