21 citations · 38 across the 3 of their papers we have counts for
3 papers
cond-mat.soft2022
Molecular dynamics study of the linear viscoelastic shear and bulk relaxation moduli of poly(tetramethylene oxide) (PTMO)
Zakiya Shireen, Elnaz Hajizadeh, Peter Daivis +1
Here we report the linear viscoelastic properties of amorphous poly(tetramethylene oxide) (PTMO), which is one of the key components in synthesizing segmented polyurethane (PU) ela…
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.soft2019★ 21 cited
Measuring Heat Flux Beyond Fourier's law
E. R. Smith, P. J. Daivis, B. D. Todd
We use nonequilibrium molecular dynamics (NEMD) to explore the effect of shear flow on heat flux. By simulating a simple fluid in a channel bounded by tethered atoms, the heat flux…