Molecular dynamics simulations of oxide ion migration in La2Ga3O7.5 with completely ordered interstitial oxide ions

Ion Migration ◽

Dynamics Simulations ◽

Oxide Ions ◽

Oxide Ion

Sodium ion migration mechanisms in silicate glasses probed by molecular dynamics simulations

Journal of Non-Crystalline Solids ◽

10.1016/s0022-3093(03)00280-1 ◽

2003 ◽

Vol 323 (1-3) ◽

pp. 147-154 ◽

Cited By ~ 50

Author(s):

A.N. Cormack ◽

J. Du ◽

T.R. Zeitler

Keyword(s):

Molecular Dynamics ◽

Silicate Glasses ◽

Sodium Ion ◽

Ion Migration ◽

Alkali ion migration mechanisms in silicate glasses probed by molecular dynamics simulations

Physical Chemistry Chemical Physics ◽

10.1039/b201721k ◽

2002 ◽

Vol 4 (14) ◽

pp. 3193-3197 ◽

Cited By ~ 114

Author(s):

A. N. Cormack ◽

J. Du ◽

T. R. Zeitler

Keyword(s):

Molecular Dynamics ◽

Silicate Glasses ◽

Ion Migration ◽

Dynamics Simulations ◽

Alkali Ion

Dynamical descriptors of bioactivity: a correlation between chemical durability and ion migration in biodegradable glasses

Physical Chemistry Chemical Physics ◽

10.1039/c6cp07203h ◽

2017 ◽

Vol 19 (9) ◽

pp. 6334-6337 ◽

Cited By ~ 2

Author(s):

Antonio Tilocca

Keyword(s):

Molecular Dynamics ◽

Chemical Durability ◽

Ion Migration ◽

Molecular dynamics simulations reveal the importance of using dynamical descriptors to rationalize and predict the behavior of biomedical glasses.

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

Molecular Physics ◽

10.1080/002689700162045 ◽

2000 ◽

Vol 98 (11) ◽

pp. 701-707

Author(s):

Alessandro Sergi, Mauro Ferrario, Francesco Bu

Keyword(s):

Molecular Dynamics ◽

Ab Initio ◽

Ab Initio Molecular Dynamics ◽

Tracer diffusion in perfectly aligned liquid crystalline phases Kinetic theory and molecular dynamics simulations

Molecular Physics ◽

10.1080/00268979709482789 ◽

1997 ◽

Vol 91 (6) ◽

pp. 993-1003 ◽

Cited By ~ 1

Author(s):

ANJALI KHARE ◽

DAVID KOFKE ◽

GLENN EVANS

Keyword(s):

Molecular Dynamics ◽

Kinetic Theory ◽

Liquid Crystalline ◽

Tracer Diffusion ◽

Crystalline Phases ◽

Liquid Crystalline Phases ◽

ERRATUM Molecular dynamics simulations of liquid crystal phases using atomistic potentials

Molecular Physics ◽

10.1080/002689798167430 ◽

1998 ◽

Vol 95 (1) ◽

pp. 121-121

Author(s):

CARL MCBRIDE MARK R. WILSON JUDITH A. K.

Keyword(s):

Molecular Dynamics ◽

Liquid Crystal ◽

Crystal Phases ◽

Dynamics Simulations ◽

Liquid Crystal Phases

Nonequilibrium Molecular Dynamics Simulations of 3-Methylhexane: The Effect of Inter- and Intramolecular Potential Models on Simulated Viscosity

The Journal of Physical Chemistry A ◽

10.1021/jp971476g ◽

1997 ◽

Vol 101 (27) ◽

pp. 5026-5026

Author(s):

Maija Lahtela ◽

Tapani A. Pakkanen ◽

Richard L. Rowley

Keyword(s):

Molecular Dynamics ◽

Nonequilibrium Molecular Dynamics ◽

Potential Models ◽

Assessment of all-atom potentials for modeling membranes: molecular dynamics simulations of solid and liquid alkanes and crystals of phospholipid fragments

Journal de Chimie Physique ◽

10.1051/jcp/1997941482 ◽

1997 ◽

Vol 94 ◽

pp. 1482-1502 ◽

Cited By ~ 27

Author(s):

DJ Tobias ◽

K Tu ◽

ML Klein

Keyword(s):

Molecular Dynamics ◽

Dynamics Simulations ◽

Liquid Alkanes

Molecular Dynamics Simulations of Retrograde Condensation in Nanoporous Shale

Proceedings of the 3rd Unconventional Resources Technology Conference ◽

10.15530/urtec-2015-2172738 ◽

2015 ◽

Cited By ~ 1

Author(s):

William R. Welch ◽

Mohammad Piri

Keyword(s):

Molecular Dynamics ◽

Retrograde Condensation ◽

MOLECULAR DYNAMICS SIMULATIONS OF RAYLEIGH AND FIRST WIND-INDUCED BREAKUP

Atomization and Sprays ◽

10.1615/atomizspr.2011002906 ◽

2011 ◽

Vol 21 (4) ◽

pp. 275-281 ◽

Cited By ~ 4

Author(s):

Kurt F. Ludwig ◽

Michael Micci

Keyword(s):

Molecular Dynamics ◽