Diffusion in binary gas mixtures studied by NMR of hyperpolarized gases and molecular dynamics simulations

R. H. Acosta; L. Agulles-Pedrós; S. Komin; D. Sebastiani; H. W. Spiess; P. Blümler

doi:10.1039/b609316g

Diffusion in binary gas mixtures studied by NMR of hyperpolarized gases and molecular dynamics simulations

Physical Chemistry Chemical Physics ◽

10.1039/b609316g ◽

2006 ◽

Vol 8 (36) ◽

pp. 4182-4188 ◽

Cited By ~ 24

Author(s):

R. H. Acosta ◽

L. Agulles-Pedrós ◽

S. Komin ◽

D. Sebastiani ◽

H. W. Spiess ◽

...

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Gas Mixtures ◽

Hyperpolarized Gases ◽

Dynamics Simulations

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Molecular Dynamics Simulations of Normal Shock Waves in Dilute Gas Mixtures

50th AIAA Aerospace Sciences Meeting including the New Horizons Forum and Aerospace Exposition ◽

10.2514/6.2012-225 ◽

2012 ◽

Author(s):

Paolo Valentini ◽

Patrick Tump ◽

Chonglin Zhang ◽

Thomas Schwartzentruber

Keyword(s):

Molecular Dynamics ◽

Shock Waves ◽

Molecular Dynamics Simulations ◽

Gas Mixtures ◽

Normal Shock ◽

Dilute Gas ◽

Dynamics Simulations

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Molecular dynamics simulations of metal-organic frameworks as membranes for gas mixtures separation

Journal of Membrane Science ◽

10.1016/j.memsci.2012.10.058 ◽

2013 ◽

Vol 428 ◽

pp. 241-250 ◽

Cited By ~ 30

Author(s):

Fredy A. Cabrales-Navarro ◽

Jose L. Gómez-Ballesteros ◽

Perla B. Balbuena

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Metal Organic Frameworks ◽

Gas Mixtures ◽

Metal Organic ◽

Dynamics Simulations

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Nonequilibrium molecular dynamics simulations of transport and separation of gas mixtures in nanoporous materials

Physical Review E ◽

10.1103/physreve.62.6942 ◽

2000 ◽

Vol 62 (5) ◽

pp. 6942-6948 ◽

Cited By ~ 48

Author(s):

Lifang Xu ◽

Muhammad Sahimi ◽

Theodore T. Tsotsis

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Gas Mixtures ◽

Nanoporous Materials ◽

Nonequilibrium Molecular Dynamics ◽

Separation Of Gas Mixtures ◽

Dynamics Simulations

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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 ◽

Molecular Dynamics Simulations ◽

Ab Initio Molecular Dynamics ◽

Dynamics Simulations

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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 ◽

Molecular Dynamics Simulations ◽

Liquid Crystalline ◽

Tracer Diffusion ◽

Crystalline Phases ◽

Liquid Crystalline Phases ◽

Dynamics Simulations

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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 ◽

Molecular Dynamics Simulations ◽

Crystal Phases ◽

Dynamics Simulations ◽

Liquid Crystal Phases

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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 ◽

Molecular Dynamics Simulations ◽

Nonequilibrium Molecular Dynamics ◽

Potential Models ◽

Dynamics Simulations

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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 ◽

Molecular Dynamics Simulations ◽

Dynamics Simulations ◽

Liquid Alkanes

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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 ◽

Molecular Dynamics Simulations ◽

Retrograde Condensation ◽

Dynamics Simulations

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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 ◽

Molecular Dynamics Simulations ◽

Dynamics Simulations

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