Showing 1–12 of 12 results
/ Date/ Name
Nov 17, 2009Anisotropy of Earth's D" layer and stacking faults in the MgSiO3 post-perovskite phaseJan 22, 2005Evolution of the structure of amorphous ice - from low-density amorphous (LDA) through high-density amorphous (HDA) to very high-density amorphous (VHDA) iceDec 3, 1993Structural Phase Trasformations via Ab-Initio Molecular DynamicsAug 9, 2007Coexistence of tetrahedral and octahedral-like sites in amorphous phase change materialsMay 24, 2000An anomalous alloy: Y_x Si_{1-x}Nov 22, 2004Simulation of structural phase transitions by metadynamicsFeb 5, 2009PLUMED: a portable plugin for free-energy calculations with molecular dynamicsNov 25, 2002Predicting crystal structures: the Parrinello-Rahman method revisitedApr 23, 2004Polyamorphism of ice at low temperatures from constant-pressure simulationsApr 11, 2001Action-derived molecular dynamics in the study of rare eventsOct 26, 2009Enhanced Sampling in the Well-Tempered EnsembleAug 19, 2002Escaping free-energy minima