Year |
Citation |
Score |
2021 |
Rokni HB, Moore JD, Gavaises M. Entropy-scaling based pseudo-component viscosity and thermal conductivity models for hydrocarbon mixtures and fuels containing iso-alkanes and two-ring saturates Fuel. 283: 118877. DOI: 10.1016/J.Fuel.2020.118877 |
0.365 |
|
2019 |
Rowane AJ, Babu VM, Rokni HB, Moore JD, Gavaises M, Wensing M, Gupta A, McHugh MA. Effect of Composition, Temperature, and Pressure on the Viscosities and Densities of Three Diesel Fuels Journal of Chemical & Engineering Data. 64: 5529-5547. DOI: 10.1021/Acs.Jced.9B00652 |
0.336 |
|
2019 |
Rokni HB, Moore JD, Gupta A, McHugh MA, Mallepally RR, Gavaises M. General method for prediction of thermal conductivity for well-characterized hydrocarbon mixtures and fuels up to extreme conditions using entropy scaling Fuel. 245: 594-604. DOI: 10.1016/J.Fuel.2019.02.044 |
0.33 |
|
2019 |
Rokni HB, Moore JD, Gupta A, McHugh MA, Gavaises M. Entropy scaling based viscosity predictions for hydrocarbon mixtures and diesel fuels up to extreme conditions Fuel. 241: 1203-1213. DOI: 10.1016/J.Fuel.2018.12.043 |
0.36 |
|
2019 |
Rokni HB, Gupta A, Moore JD, McHugh MA, Bamgbade BA, Gavaises M. Purely predictive method for density, compressibility, and expansivity for hydrocarbon mixtures and diesel and jet fuels up to high temperatures and pressures Fuel. 236: 1377-1390. DOI: 10.1016/J.Fuel.2018.09.041 |
0.369 |
|
2016 |
Ross RB, Aeschliman DB, Ahmad R, Brennan JK, Brostrom ML, Frankel KA, Moore JD, Moore JD, Mountain RD, Poirier DM, Thommes M, Shen VK, Schultz NE, Siderius DW, Smith KD. Adsorption, X-ray Diffraction, Photoelectron, and Atomic Emission Spectroscopy Benchmark Studies for the Eighth Industrial Fluid Properties Simulation Challenge. Adsorption Science & Technology : Interface Science For Advanced Materials & Technologies. 34: 13-41. PMID 27840543 DOI: 10.1177/0263617415619541 |
0.691 |
|
2016 |
Schultz NE, Ahmad R, Brennan JK, Frankel KA, Moore JD, Moore JD, Mountain RD, Ross RB, Thommes M, Shen VK, Siderius DW, Smith KD. The Eighth Industrial Fluids Properties Simulation Challenge. Adsorption Science & Technology : Interface Science For Advanced Materials & Technologies. 34: 3-12. PMID 27840542 DOI: 10.1177/0263617415619521 |
0.697 |
|
2016 |
Moore JD, Barnes BC, Izvekov S, Lísal M, Sellers MS, Taylor DE, Brennan JK. A coarse-grain force field for RDX: Density dependent and energy conserving. The Journal of Chemical Physics. 144: 104501. PMID 26979691 DOI: 10.1063/1.4942520 |
0.587 |
|
2014 |
Brennan JK, Lísal M, Moore JD, Izvekov S, Schweigert IV, Larentzos JP. Coarse-Grain Model Simulations of Nonequilibrium Dynamics in Heterogeneous Materials. The Journal of Physical Chemistry Letters. 5: 2144-9. PMID 26270506 DOI: 10.1021/Jz500756S |
0.604 |
|
2014 |
Ross RB, Brennan JK, Frankel KA, Moore JD, Mountain RD, Ahmad R, Thommes M, Shen VK, Schultz NE, Siderius DW, Smith KD. Perfluorohexane adsorption in BCR-704 Faujasite zeolite benchmark studies for the seventh industrial fluid properties simulation challenge Fluid Phase Equilibria. 366: 141-145. DOI: 10.1016/J.Fluid.2013.12.025 |
0.689 |
|
2014 |
Larentzos JP, Brennan JK, Moore JD, Lísal M, Mattson WD. Parallel implementation of isothermal and isoenergetic Dissipative Particle Dynamics using Shardlow-like splitting algorithms Computer Physics Communications. 185: 1987-1998. DOI: 10.1016/J.Cpc.2014.03.029 |
0.583 |
|
2011 |
Palmer JC, Moore JD, Roussel TJ, Brennan JK, Gubbins KE. Adsorptive behavior of CO2, CH4 and their mixtures in carbon nanospace: a molecular simulation study. Physical Chemistry Chemical Physics : Pccp. 13: 3985-96. PMID 21234499 DOI: 10.1039/C0Cp02281K |
0.746 |
|
2011 |
Gubbins KE, Liu YC, Moore JD, Palmer JC. The role of molecular modeling in confined systems: impact and prospects. Physical Chemistry Chemical Physics : Pccp. 13: 58-85. PMID 21116563 DOI: 10.1039/C0Cp01475C |
0.708 |
|
2011 |
Palmer JC, Moore JD, Brennan JK, Gubbins KE. Simulating local adsorption isotherms in structurally complex porous materials: A direct assessment of the slit pore model Journal of Physical Chemistry Letters. 2: 165-169. DOI: 10.1021/Jz1015668 |
0.742 |
|
2011 |
Serbezov A, Moore JD, Wu Y. Adsorption equilibrium of water vapor on selexsorb-CDX commercial activated alumina adsorbent Journal of Chemical and Engineering Data. 56: 1762-1769. DOI: 10.1021/Je100473F |
0.442 |
|
2011 |
Palmer JC, Moore JD, Brennan JK, Gubbins KE. Adsorption and diffusion of argon in disordered nanoporous carbons Adsorption. 17: 189-199. DOI: 10.1007/S10450-010-9308-0 |
0.758 |
|
2010 |
Chen Q, Moore JD, Liu YC, Roussel TJ, Wang Q, Wu T, Gubbins KE. Transition from single-file to Fickian diffusion for binary mixtures in single-walled carbon nanotubes. The Journal of Chemical Physics. 133: 094501. PMID 20831318 DOI: 10.1063/1.3469811 |
0.6 |
|
2010 |
Liu YC, Moore JD, Roussel TJ, Gubbins KE. Dual diffusion mechanism of argon confined in single-walled carbon nanotube bundles. Physical Chemistry Chemical Physics : Pccp. 12: 6632-40. PMID 20422115 DOI: 10.1039/B927152J |
0.664 |
|
2010 |
Gubbins KE, Moore JD. Molecular modeling of matter: Impact and prospects in engineering Industrial and Engineering Chemistry Research. 49: 3026-3046. DOI: 10.1021/Ie901909C |
0.464 |
|
2010 |
Moore JD, Palmer JC, Liu YC, Roussel TJ, Brennan JK, Gubbins KE. Adsorption and diffusion of argon confined in ordered and disordered microporous carbons Applied Surface Science. 256: 5131-5136. DOI: 10.1016/J.Apsusc.2009.12.071 |
0.738 |
|
2009 |
Chen Q, Wang Q, Liu YC, Wu T, Kang Y, Moore JD, Gubbins KE. Energetics investigation on encapsulation of protein/peptide drugs in carbon nanotubes. The Journal of Chemical Physics. 131: 015101. PMID 19586122 DOI: 10.1063/1.3148025 |
0.493 |
|
2008 |
Liu Y, Shen J, Gubbins KE, Moore JD, Wu T, Wang Q. Diffusion dynamics of water controlled by topology of potential energy surface inside carbon nanotubes Physical Review B. 77. DOI: 10.1103/Physrevb.77.125438 |
0.587 |
|
2005 |
Moore JD, Serbezov A. Correlation of Adsorption Equilibrium Data for Water Vapor on F-200 Activated Alumina Adsorption. 11: 65-75. DOI: 10.1007/S10450-005-1094-8 |
0.392 |
|
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