28 citations · 28 across the 5 of their papers we have counts for
14 papers
Amorphous silica at surfaces and interfaces: simulation studies
Juergen Horbach, Torsten Stuehn, Claus Mischler +2
The structure of surfaces and interfaces of silica (SiO2) is investigated by large scale molecular dynamics computer simulations. In the case of a free silica surface, the results…
Vibrational properties of a sodium tetrasilicate glass: Ab initio versus Classical Force Fields
S. Ispas, N. Zotov, S. De Wispelaere +1
We have determined the vibrational properties of a sodium tetrasilicate (NaSiO) glass model generated by molecular dynamics simulations. The study has been carrie…
Dynamics of a rod in a random static environment: non-Gaussianity at large length scales
A. J. Moreno, W. Kob
We present molecular dynamics simulations of the motion of a single rod in a two-dimensional random static array of disks. For long rods the mean-squared displacement of the center…
Supercooled liquids, the glass transition, and computer simulations
Walter Kob
Lecture notes for LES HOUCHES 2002 SUMMER SCHOOL - SESSION LXXVII on SLOW RELAXATIONS AND NONEQUILIBRIUM DYNAMICS IN CONDENSED MATTER; Les Houches: July 1-26, 2002
The importance of intermediate range order in silicates: molecular dynamics simulation studies
J. Horbach, A. Winkler, W. Kob +1
We present the results of large scale computer simulations in which we investigate the structural and dynamic properties of silicate melts with the compositions (Na_2O)2(SiO_2) and…
Simulation of models for the glass transition: Is there progress?
Kurt Binder, Jörg Baschnagel, Walter Kob +1
The glass transition of supercooled fluids is a particular challenge for computer simulation, because the (longest) relaxation times increase by about 15 decades upon approaching t…