Ion solvation in polarizable water: molecular dynamics simulations

1991 ◽  
Vol 113 (7) ◽  
pp. 2481-2486 ◽  
Author(s):  
Liem X. Dang ◽  
Julia E. Rice ◽  
James Caldwell ◽  
Peter A. Kollman
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Ion Solvation ◽  
Dynamics Simulations

scholarly journals Ab initio molecular dynamics simulations of aluminum ion solvation in water clusters

2000 ◽  
Vol 322 (6) ◽  
pp. 447-453 ◽  
Author(s):  
M.I. Lubin ◽  
E.J. Bylaska ◽  
J.H. Weare
Keyword(s):  
Molecular Dynamics ◽  
Ab Initio ◽  
Molecular Dynamics Simulations ◽  
Water Clusters ◽  
Ion Solvation ◽  
Ab Initio Molecular Dynamics ◽  
Aluminum Ion ◽  
Dynamics Simulations

Structure of phosphorus-selenium glasses: results from ab initio molecular dynamics simulations

2000 ◽  
Vol 98 (11) ◽  
pp. 701-707
Author(s):  
Alessandro Sergi, Mauro Ferrario, Francesco Bu
Keyword(s):  
Molecular Dynamics ◽  
Ab Initio ◽  
Molecular Dynamics Simulations ◽  
Ab Initio Molecular Dynamics ◽  
Dynamics Simulations

ERRATUM Molecular dynamics simulations of liquid crystal phases using atomistic potentials

1998 ◽  
Vol 95 (1) ◽  
pp. 121-121
Author(s):  
CARL MCBRIDE MARK R. WILSON JUDITH A. K.
Keyword(s):  
Molecular Dynamics ◽  
Liquid Crystal ◽  
Molecular Dynamics Simulations ◽  
Crystal Phases ◽  
Dynamics Simulations ◽  
Liquid Crystal Phases

MOLECULAR DYNAMICS SIMULATIONS OF RAYLEIGH AND FIRST WIND-INDUCED BREAKUP

2011 ◽  
Vol 21 (4) ◽  
pp. 275-281 ◽  
Author(s):  
Kurt F. Ludwig ◽  
Michael Micci
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Dynamics Simulations
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