scholarly journals A simple model for the molecular dynamics of condensed phases

1991 ◽  
Vol 5 (5) ◽  
pp. 479
Author(s):  
G. S. Pawley
Keyword(s):  
Molecular Dynamics ◽  
Simple Model ◽  
Condensed Phases

Glycerol condensed phases Part I. A molecular dynamics study

1999 ◽  
Vol 1 (5) ◽  
pp. 871-877 ◽  
Author(s):  
Riccardo Chelli ◽  
Piero Procacci ◽  
Gianni Cardini ◽  
Raffaele G. Della Valle ◽  
Salvatore Califano
Keyword(s):  
Molecular Dynamics ◽  
Condensed Phases

Size Effect in the Shear-Coupled Migration of Grain Boundaries Pinned by Triple Junctions

2009 ◽  
Vol 1224 ◽  
Author(s):  
Javier Gil Sevillano ◽  
Aitor Luque ◽  
Javier Aldazabal ◽  
José Manuel Martinez-Esnaola
Keyword(s):  
Molecular Dynamics ◽  
Simple Model ◽  
Low Temperature ◽  
Size Effect ◽  
Model Structure ◽  
Triple Junctions ◽  
Columnar Grains ◽  
Tilt Boundaries ◽  
Relationship Breakdown ◽  
Dynamics Simulations

AbstractThis paper presents molecular dynamics simulations of shear-coupled migration of tilt boundaries pinned by triple junctions in a simple model structure of columnar grains of different sizes. Simulations are for copper at 300 K. The phenomenon is of interest as a possible explanation of the Hall-Petch relationship breakdown in nano-grained polycrystals deformed at high or moderate strain rate and low-temperature.

Molecular dynamics studies of the condensed phases of n-butane and their transitions

1987 ◽  
Vol 61 (3) ◽  
pp. 693-709 ◽  
Author(s):  
Keith Refson ◽  
G. Stuart Pawley
Keyword(s):  
Molecular Dynamics ◽  
Condensed Phases

Molecular dynamics studies on zeolites. II: A simple model for silicates applied to anhydrous natrolite

Zeolites ◽  
1987 ◽  
Vol 7 (6) ◽  
pp. 522-527 ◽  
Author(s):  
P. Demontis ◽  
G.B. Suffritti ◽  
S. Quartieri ◽  
E.S. Fois ◽  
A. Gamba
Keyword(s):  
Molecular Dynamics ◽  
Simple Model

scholarly journals Molecular Dynamics by Light Scattering in the Condensed Phases of Ar, Kr, and Xe

1973 ◽  
Vol 30 (17) ◽  
pp. 814-814
Author(s):  
P. A. Fleury ◽  
J. M. Worlock ◽  
H. L. Carter
Keyword(s):  
Molecular Dynamics ◽  
Light Scattering ◽  
Condensed Phases

Molecular dynamics studies of the condensed phases of n-butane and their transitions

1987 ◽  
Vol 61 (3) ◽  
pp. 669-692 ◽  
Author(s):  
Keith Refson ◽  
G. Stuart Pawley
Keyword(s):  
Molecular Dynamics ◽  
Condensed Phases
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