Effects of Temperature on the Properties of Glycerol: A Computer Simulation Study of Five Different Force Fields

David A. Jahn; Frederick O. Akinkunmi; Nicolas Giovambattista

doi:10.1021/jp5059098

Effects of Temperature on the Properties of Glycerol: A Computer Simulation Study of Five Different Force Fields

The Journal of Physical Chemistry B ◽

10.1021/jp5059098 ◽

2014 ◽

Vol 118 (38) ◽

pp. 11284-11294 ◽

Cited By ~ 26

Author(s):

David A. Jahn ◽

Frederick O. Akinkunmi ◽

Nicolas Giovambattista

Keyword(s):

Computer Simulation ◽

Simulation Study ◽

Force Fields ◽

Computer Simulation Study ◽

Effects Of Temperature

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Effects of Temperature on the Thermodynamic and Dynamical Properties of Glycerol–Water Mixtures: A Computer Simulation Study of Three Different Force Fields

The Journal of Physical Chemistry B ◽

10.1021/acs.jpcb.5b00439 ◽

2015 ◽

Vol 119 (20) ◽

pp. 6250-6261 ◽

Cited By ~ 13

Author(s):

Frederick O. Akinkunmi ◽

David A. Jahn ◽

Nicolas Giovambattista

Keyword(s):

Computer Simulation ◽

Simulation Study ◽

Force Fields ◽

Computer Simulation Study ◽

Glycerol Water ◽

Dynamical Properties ◽

Effects Of Temperature

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Conformational and Dynamic Properties of Poly(ethylene oxide) in BMIM+BF4–: A Microsecond Computer Simulation Study Using ab Initio Force Fields

Macromolecules ◽

10.1021/acs.macromol.8b01002 ◽

2018 ◽

Vol 51 (14) ◽

pp. 5336-5345 ◽

Cited By ~ 7

Author(s):

Chang Yun Son ◽

Jesse G. McDaniel ◽

Qiang Cui ◽

Arun Yethiraj

Keyword(s):

Computer Simulation ◽

Ethylene Oxide ◽

Ab Initio ◽

Simulation Study ◽

Force Fields ◽

Dynamic Properties ◽

Computer Simulation Study ◽

Poly Ethylene Oxide ◽

Poly Ethylene

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A computer simulation study of the effects of temperature change rate on austenite kinetics in laser hardening

Surface and Coatings Technology ◽

10.1016/j.surfcoat.2015.01.075 ◽

2015 ◽

Vol 273 ◽

pp. 60-76 ◽

Cited By ~ 19

Author(s):

Marko Bojinović ◽

Nikolaj Mole ◽

Boris Štok

Keyword(s):

Computer Simulation ◽

Temperature Change ◽

Simulation Study ◽

Laser Hardening ◽

Computer Simulation Study ◽

Change Rate ◽

Temperature Change Rate ◽

Effects Of Temperature

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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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An Experimental and Computer Simulation Study of Tailing Flow Attributed to A Dam Breach

IOP Conference Series Earth and Environmental Science ◽

10.1088/1755-1315/719/4/042065 ◽

2021 ◽

Vol 719 (4) ◽

pp. 042065

Author(s):

Changtai Luo

Keyword(s):

Computer Simulation ◽

Simulation Study ◽

Dam Breach ◽

Computer Simulation Study

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Sensitivity and specificity of normality tests and consequences on reference interval accuracy at small sample size: a computer-simulation study

Veterinary Clinical Pathology ◽

10.1111/vcp.12390 ◽

2016 ◽

Vol 45 (4) ◽

pp. 648-656 ◽

Cited By ~ 24

Author(s):

Kevin Le Boedec

Keyword(s):

Computer Simulation ◽

Sample Size ◽

Sensitivity And Specificity ◽

Simulation Study ◽

Small Sample Size ◽

Reference Interval ◽

Small Sample ◽

Computer Simulation Study

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Investigating the cooling rate dependence of amorphous silica: A computer simulation study

Berichte der Bunsengesellschaft für physikalische Chemie ◽

10.1002/bbpc.19961000906 ◽

1996 ◽

Vol 100 (9) ◽

pp. 1399-1401 ◽

Cited By ~ 11

Author(s):

K. Vollmayr ◽

W. Kob

Keyword(s):

Computer Simulation ◽

Cooling Rate ◽

Simulation Study ◽

Amorphous Silica ◽

Rate Dependence ◽

Computer Simulation Study

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The selectivity of protein-imprinted gels and its relation to protein properties: A computer simulation study

Journal of Molecular Recognition ◽

10.1002/jmr.2607 ◽

2017 ◽

Vol 30 (7) ◽

pp. e2607 ◽

Cited By ~ 2

Author(s):

Rami Yankelov ◽

Irena Yungerman ◽

Simcha Srebnik

Keyword(s):

Computer Simulation ◽

Simulation Study ◽

Computer Simulation Study ◽

Protein Properties

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Computer simulation study of self-diffusion in Pd(001) surface

Journal of Physics and Chemistry of Solids ◽

10.1016/j.jpcs.2006.11.030 ◽

2007 ◽

Vol 68 (3) ◽

pp. 389-393 ◽

Cited By ~ 2

Author(s):

Guo-Xiang Chen ◽

Jian-Min Zhang ◽

Ke-Wei Xu ◽

Vincent Ji

Keyword(s):

Computer Simulation ◽

Simulation Study ◽

Computer Simulation Study ◽

Self Diffusion

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Decay of trapped electrons by tunnelling to scavenger molecules in the systems with dispersion of energy of the trapping sites. A computer simulation study

International Journal of Radiation Applications and Instrumentation Part C Radiation Physics and Chemistry ◽

10.1016/1359-0197(91)90219-r ◽

1991 ◽

Vol 38 (2) ◽

pp. 149-153

Author(s):

BŁzej Feret ◽

Witold M. Bartczak ◽

Jerzy Kroh

Keyword(s):

Computer Simulation ◽

Simulation Study ◽

Computer Simulation Study ◽

Trapped Electrons ◽

Trapping Sites

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