Pressure and Temperature Dependence of the Hydrogen Bonding in Supercritical Ethanol:  A Computer Simulation Study

Dimitris Dellis; Michalis Chalaris; Jannis Samios

doi:10.1021/jp051688a

Pressure and Temperature Dependence of the Hydrogen Bonding in Supercritical Ethanol: A Computer Simulation Study

The Journal of Physical Chemistry B ◽

10.1021/jp051688a ◽

2005 ◽

Vol 109 (39) ◽

pp. 18575-18590 ◽

Cited By ~ 24

Author(s):

Dimitris Dellis ◽

Michalis Chalaris ◽

Jannis Samios

Keyword(s):

Computer Simulation ◽

Hydrogen Bonding ◽

Temperature Dependence ◽

Simulation Study ◽

Computer Simulation Study ◽

Supercritical Ethanol

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Computer Simulation Study of the Density and Temperature Dependence of Fundamental and Overtone Vibrational Dephasing in Nitrogen: Interplay between Different Mechanisms of Dephasing

The Journal of Physical Chemistry A ◽

10.1021/jp9915533 ◽

1999 ◽

Vol 103 (48) ◽

pp. 9579-9590 ◽

Cited By ~ 5

Author(s):

N. Gayathri ◽

B. Bagchi

Keyword(s):

Computer Simulation ◽

Temperature Dependence ◽

Simulation Study ◽

Computer Simulation Study ◽

Vibrational Dephasing

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A computer simulation study of the temperature dependence of the hydrophobic hydration

The Journal of Chemical Physics ◽

10.1063/1.465634 ◽

1993 ◽

Vol 99 (10) ◽

pp. 8075-8094 ◽

Cited By ~ 213

Author(s):

B. Guillot ◽

Y. Guissani

Keyword(s):

Computer Simulation ◽

Temperature Dependence ◽

Simulation Study ◽

Hydrophobic Hydration ◽

Computer Simulation Study

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The hydrogen bonding structure of water in the vicinity of apolar interfaces: a computer simulation study

Journal of Physics Condensed Matter ◽

10.1088/0953-8984/16/45/006 ◽

2004 ◽

Vol 16 (45) ◽

pp. S5389-S5402 ◽

Cited By ~ 15

Author(s):

Pál Jedlovszky

Keyword(s):

Computer Simulation ◽

Hydrogen Bonding ◽

Simulation Study ◽

Computer Simulation Study ◽

Structure Of Water ◽

Bonding Structure

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Hydrogen bonding in liquid alcohols: a computer simulation study

Journal of Molecular Structure ◽

10.1016/s0022-2860(97)00038-0 ◽

1997 ◽

Vol 416 (1-3) ◽

pp. 243-248 ◽

Cited By ~ 155

Author(s):

J.A. Padró ◽

L. Saiz ◽

E. Guàrdia

Keyword(s):

Computer Simulation ◽

Hydrogen Bonding ◽

Simulation Study ◽

Computer Simulation Study

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Hydrogen Bonding In Aqueous Mixtures Containing Aprotic Solvents: A Computer Simulation Study

International Conference of Computational Methods in Sciences and Engineering 2004 (ICCMSE 2004) ◽

10.1201/9780429081385-28 ◽

2019 ◽

pp. 110-114

Author(s):

M. Chalaris ◽

J. Samios

Keyword(s):

Computer Simulation ◽

Hydrogen Bonding ◽

Simulation Study ◽

Aprotic Solvents ◽

Aqueous Mixtures ◽

Computer Simulation Study

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A molecular dynamics computer simulation study of the temperature dependence of hydration of 1,4-dioxane and 1,3-dioxane

Chemical Physics ◽

10.1016/0301-0104(86)87020-3 ◽

1986 ◽

Vol 101 (1) ◽

pp. 27-44 ◽

Cited By ~ 11

Author(s):

Klaas Remerie ◽

Jan B.F.N. Engberts ◽

Wilfred F. Van Gunsteren

Keyword(s):

Molecular Dynamics ◽

Computer Simulation ◽

Temperature Dependence ◽

Simulation Study ◽

Computer Simulation Study

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Temperature dependence of the colloidal agglomeration inhibition: Computer simulation study

The Journal of Chemical Physics ◽

10.1063/1.2768519 ◽

2007 ◽

Vol 127 (11) ◽

pp. 114706 ◽

Cited By ~ 7

Author(s):

Mariana Barcenas ◽

Janna Douda ◽

Yurko Duda

Keyword(s):

Computer Simulation ◽

Temperature Dependence ◽

Simulation Study ◽

Computer Simulation Study

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Temperature dependence of the short-range repulsion between hydrated phospholipid membranes: A computer simulation study

Biointerphases ◽

10.1116/1.2771541 ◽

2007 ◽

Vol 2 (3) ◽

pp. 105-108 ◽

Cited By ~ 5

Author(s):

Alexander Pertsin ◽

Michael Grunze

Keyword(s):

Computer Simulation ◽

Temperature Dependence ◽

Simulation Study ◽

Short Range ◽

Phospholipid Membranes ◽

Computer Simulation Study ◽

Short Range Repulsion

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A computer simulation study of the temperature dependence of the tracer diffusivity and Haven ratio in a model of a highly defective solid

Philosophical Magazine A ◽

10.1080/01418618208240908 ◽

1982 ◽

Vol 45 (6) ◽

pp. 929-940 ◽

Cited By ~ 6

Author(s):

G. E. Murch

Keyword(s):

Computer Simulation ◽

Temperature Dependence ◽

Simulation Study ◽

Tracer Diffusivity ◽

Computer Simulation Study

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396 Validation of ECG indices of ventricular repolarization heterogeneity: a computer simulation study

EP Europace ◽

10.1016/s1099-5129(05)80252-1 ◽

2005 ◽

Vol 7 ◽

pp. 85-85

Keyword(s):

Computer Simulation ◽

Simulation Study ◽

Ventricular Repolarization ◽

Computer Simulation Study

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