id	author	title	date	pages	extension	mime	words	sentence	flesch	summary	cache	txt
df65v694z04	Kelsey M. Stocker	Development and Application of Non-Periodic and Non-Equilibrium Molecular Dynamics Simulation Methods	2014		.txt	text/plain	355	13	23	Velocity shearing and scaling reverse non-equilibrium molecular dynamics (VSS-RNEMD) for periodic systems is used to study the effect of ligand chain length and mixtures of chain lengths on the interfacial thermal conductance (G) of Au(111) interfaces protected by a monolayer of alkanethiolate ligands and solvated in hexane. Non-periodic geometries present problems for traditional affine scaling techniques in constant-pressure constant-temperature simulations.	cache/df65v694z04.txt	txt/df65v694z04.txt