91 citations · 350 across the 8 of their papers we have counts for
8 papers
Age and Structure of a Model Vapor-Deposited Glass
Daniel Reid, Ivan Lyubimov, Mark Ediger +1
Glass films prepared by a process of physical vapor deposition have been shown to have thermodynamic and kinetic stability comparable to those of ordinary glasses aged for thousand…
Inherent Structure Energy is a Good Indicator of Molecular Mobility in Glasses
Julian Helfferich, Ivan Lyubimov, Daniel Reid +1
Glasses produced via physical vapor deposition can display greater kinetic stability and lower enthalpy than glasses prepared by liquid cooling. While the reduced enthalpy has ofte…
Model Vapor-Deposited Glasses: Growth Front and Composition Effects
Ivan Lyubimov, Mark D. Ediger, Juan J. de Pablo
A growing body of experimental work indicates that physical vapor deposition provides an effective route for preparation of stable glasses, whose properties correspond in some case…
Thermodynamic consistency in variable-level coarse-graining of polymeric liquids
Anthony J. Clark, Jay McCarty, Ivan Y. Lyubimov +1
Numerically optimized reduced descriptions of macromolecular liquids often present thermodynamic inconsistency with atomistic level descriptions even if the total correlation funct…
A First Principle Approach to Rescale the Dynamics of Simulated Coarse-Grained Macromolecular Liquids
I. Y. Lyubimov, M. G. Guenza
We present a detailed derivation and testing of our approach to rescale the dynamics of mesoscale simulations of coarse-grained polymer melts (I. Y. Lyubimov et al. J. Chem. Phys.…
Analytical Rescaling of Polymer Dynamics from Mesoscale Simulations
I. Y. Lyubimov, J. McCarty, A. Clark +1
We present a theoretical approach to scale the artificially fast dynamics of simulated coarse-grained polymer liquids down to its realistic value. As coarse-graining affects entrop…