| Year |
Citation |
Score |
| 2021 |
Middlebrooks SA, Zhao X, Ford RM, Cummings PT. A Mathematical Model for Escherichia coli Chemotaxis to Competing Stimuli. Biotechnology and Bioengineering. PMID 34463958 DOI: 10.1002/bit.27930 |
0.473 |
|
| 2021 |
Kalyuzhnyi YV, Nezbeda I, Cummings PT. Integral equation theory for mixtures of spherical and patchy colloids. 2. Numerical results. Soft Matter. PMID 33662078 DOI: 10.1039/d0sm02284e |
0.536 |
|
| 2020 |
Kalyuzhnyi YV, Nezbeda I, Cummings PT. Integral equation theory for a mixture of spherical and patchy colloids: analytical description. Soft Matter. PMID 32201867 DOI: 10.1039/C9Sm02309G |
0.589 |
|
| 2020 |
Zheng T, Zhang Y, Wu C, Zhou L, Cummings PT. Molecular investigations of tripeptide adsorption onto TiO2 surfaces: Synergetic effects of surface nanostructure, hydroxylation and bioactive ions Applied Surface Science. 512: 145713. DOI: 10.1016/J.Apsusc.2020.145713 |
0.323 |
|
| 2019 |
Black JE, Summers AZ, Iacovella CR, Cummings PT, McCabe C. Investigation of the Impact of Cross-Polymerization on the Structural and Frictional Properties of Alkylsilane Monolayers Using Molecular Simulation. Nanomaterials (Basel, Switzerland). 9. PMID 31010181 DOI: 10.3390/Nano9040639 |
0.302 |
|
| 2019 |
Osti NC, Matsumoto RA, Thompson MW, Cummings PT, Tyagi M, Mamontov E. Microscopic Dynamics in an Ionic Liquid Augmented with Organic Solvents The Journal of Physical Chemistry C. 123: 19354-19361. DOI: 10.1021/Acs.Jpcc.9B05119 |
0.337 |
|
| 2019 |
Zhang Y, Dyatkin B, Cummings PT. Molecular Investigation of Oxidized Graphene: Anatomy of the Double-Layer Structure and Ion Dynamics Journal of Physical Chemistry C. DOI: 10.1021/Acs.Jpcc.9B01617 |
0.321 |
|
| 2018 |
Hvozd TV, Kalyuzhnyi YV, Cummings PT. Phase Equilibria of Polydisperse Square-Well Chain Fluid Confined in Random Porous Media: TPT of Wertheim and Scaled Particle Theory. The Journal of Physical Chemistry. B. PMID 29656640 DOI: 10.1021/Acs.Jpcb.7B11741 |
0.309 |
|
| 2018 |
Kalyuzhnyi Y, Reščič J, Holovko M, Cummings P. Primitive models of room temperature ionic liquids. Liquid-gas phase coexistence Journal of Molecular Liquids. 270: 7-13. DOI: 10.1016/J.Molliq.2018.01.109 |
0.368 |
|
| 2018 |
Dyatkin B, Osti NC, Gallegos A, Zhang Y, Mamontov E, Cummings PT, Wu J, Gogotsi Y. Electrolyte cation length influences electrosorption and dynamics in porous carbon supercapacitors Electrochimica Acta. 283: 882-893. DOI: 10.1016/J.Electacta.2018.06.200 |
0.351 |
|
| 2018 |
Dyatkin B, Osti NC, Zhang Y, Wang H, Mamontov E, Heller WT, Zhang P, Rother G, Cummings PT, Wesolowski DJ, Gogotsi Y. Ionic liquid structure, dynamics, and electrosorption in carbon electrodes with bimodal pores and heterogeneous surfaces Carbon. 129: 104-118. DOI: 10.1016/J.Carbon.2017.12.001 |
0.334 |
|
| 2017 |
Summers AZ, Iacovella CR, Cummings PT, McCabe C. Investigating Alkylsilane Monolayer Tribology at a Single-Asperity Contact with Molecular Dynamics Simulation. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 28915731 DOI: 10.1021/Acs.Langmuir.7B02479 |
0.336 |
|
| 2017 |
Kalyuzhnyi YV, Jamnik A, Cummings PT. Melting upon cooling and freezing upon heating: fluid-solid phase diagram for Švejk-Hašek model of dimerizing hard spheres. Soft Matter. PMID 28097283 DOI: 10.1039/C6Sm02572B |
0.318 |
|
| 2016 |
Reščič J, Kalyuzhnyi YV, Cummings PT. Shielded attractive shell model again: resummed thermodynamic perturbation theory for central force potential. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 28: 414011. PMID 27545613 DOI: 10.1088/0953-8984/28/41/414011 |
0.34 |
|
| 2016 |
Zheng T, Wu C, Chen M, Zhang Y, Cummings PT. A DFT study of water adsorption on rutile TiO2 (110) surface: The effects of surface steps. The Journal of Chemical Physics. 145: 044702. PMID 27475381 DOI: 10.1063/1.4958969 |
0.351 |
|
| 2016 |
Summers AZ, Iacovella CR, Billingsley MR, Arnold ST, Cummings PT, McCabe C. Influence of Surface Morphology on the Shear-Induced Wear of Alkylsilane Monolayers: Molecular Dynamics Study. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 26885941 DOI: 10.1021/Acs.Langmuir.5B03862 |
0.307 |
|
| 2016 |
Dyatkin B, Zhang Y, Mamontov E, Kolesnikov AI, Cheng Y, Meyer HM, Cummings PT, Gogotsi Y. Influence of Surface Oxidation on Ion Dynamics and Capacitance in Porous and Nonporous Carbon Electrodes Journal of Physical Chemistry C. 120: 8730-8741. DOI: 10.1021/Acs.Jpcc.6B01204 |
0.31 |
|
| 2016 |
Guo C, Wu C, Chen M, Zheng T, Chen N, Cummings PT. Molecular modeling of fibronectin adsorption on topographically nanostructured rutile (110) surfaces Applied Surface Science. 384: 36-44. DOI: 10.1016/J.Apsusc.2016.05.014 |
0.308 |
|
| 2016 |
Feng G, Zhao W, Cummings PT, Li S. Molecular simulation study of dynamical properties of room temperature ionic liquids with carbon pieces Science China Chemistry. 1-7. DOI: 10.1007/S11426-016-5580-5 |
0.407 |
|
| 2015 |
Haley JD, Iacovella CR, Cummings PT, McCabe C. Examining the aggregation behavior of polymer grafted nanoparticles using molecular simulation and theory. The Journal of Chemical Physics. 143: 054904. PMID 26254667 DOI: 10.1063/1.4927819 |
0.327 |
|
| 2015 |
Gai L, Iacovella CR, Wan L, McCabe C, Cummings PT. Examination of the phase transition behavior of nano-confined fluids by statistical temperature molecular dynamics. The Journal of Chemical Physics. 143: 054504. PMID 26254658 DOI: 10.1063/1.4927710 |
0.317 |
|
| 2015 |
Kalyuzhnyi YV, Vasilyev OA, Cummings PT. Inverse patchy colloids with two and three patches. Analytical and numerical study. The Journal of Chemical Physics. 143: 044904. PMID 26233161 DOI: 10.1063/1.4927168 |
0.377 |
|
| 2015 |
Black JE, Iacovella CR, Cummings PT, McCabe C. Molecular dynamics study of alkylsilane monolayers on realistic amorphous silica surfaces. Langmuir : the Acs Journal of Surfaces and Colloids. 31: 3086-93. PMID 25720502 DOI: 10.1021/La5049858 |
0.356 |
|
| 2015 |
Uysal A, Zhou H, Feng G, Lee SS, Li S, Cummings PT, Fulvio PF, Dai S, McDonough JK, Gogotsi Y, Fenter P. Interfacial ionic 'liquids': connecting static and dynamic structures. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 27: 032101. PMID 25475119 DOI: 10.1088/0953-8984/27/3/032101 |
0.323 |
|
| 2015 |
Chialvo AA, Vlcek L, Cummings PT. Compounding effects of fluid confinement and surface strain on the wet-dry transition, thermodynamic response, and dynamics of water-graphene systems Molecular Physics. 113: 1033-1042. DOI: 10.1080/00268976.2014.968228 |
0.316 |
|
| 2015 |
Black JM, Baris Okatan M, Feng G, Cummings PT, Kalinin SV, Balke N. Topological defects in electric double layers of ionic liquids at carbon interfaces Nano Energy. 15: 737-745. DOI: 10.1016/J.Nanoen.2015.05.037 |
0.3 |
|
| 2015 |
Feng G, Li S, Zhao W, Cummings PT. Microstructure of room temperature ionic liquids at stepped graphite electrodes Aiche Journal. 61: 3022-3028. DOI: 10.1002/Aic.14927 |
0.391 |
|
| 2014 |
Jallouk AP, Cummings PT. Audibilization: Data Analysis by Ear. Journal of Chemical Theory and Computation. 10: 1387-94. PMID 26580358 DOI: 10.1021/Ct401105X |
0.364 |
|
| 2014 |
Kalyuzhnyi YV, Holovko M, Patsahan T, Cummings PT. Phase Behavior and Percolation Properties of the Patchy Colloidal Fluids in the Random Porous Media. The Journal of Physical Chemistry Letters. 5: 4260-4. PMID 26273972 DOI: 10.1021/Jz502135F |
0.308 |
|
| 2014 |
Li S, Bañuelos JL, Zhang P, Feng G, Dai S, Rother G, Cummings PT. Toward understanding the structural heterogeneity and ion pair stability in dicationic ionic liquids. Soft Matter. 10: 9193-200. PMID 25328976 DOI: 10.1039/C4Sm01742K |
0.32 |
|
| 2014 |
Li S, Feng G, Cummings PT. Interfaces of dicationic ionic liquids and graphene: a molecular dynamics simulation study. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 26: 284106. PMID 24920318 DOI: 10.1088/0953-8984/26/28/284106 |
0.326 |
|
| 2014 |
Uysal A, Zhou H, Feng G, Lee SS, Li S, Fenter P, Cummings PT, Fulvio PF, Dai S, McDonough JK, Gogotsi Y. Structural origins of potential dependent hysteresis at the electrified graphene/ionic liquid interface Journal of Physical Chemistry C. 118: 569-574. DOI: 10.1021/Jp4111025 |
0.327 |
|
| 2014 |
Li S, Van Aken KL, McDonough JK, Feng G, Gogotsi Y, Cummings PT. The electrical double layer of dicationic ionic liquids at onion-like carbon surface Journal of Physical Chemistry C. 118: 3901-3909. DOI: 10.1021/Jp409888F |
0.427 |
|
| 2014 |
Bañuelos JL, Feng G, Fulvio PF, Li S, Rother G, Dai S, Cummings PT, Wesolowski DJ. Densification of ionic liquid molecules within a hierarchical nanoporous carbon structure revealed by small-angle scattering and molecular dynamics simulation Chemistry of Materials. 26: 1144-1153. DOI: 10.1021/Cm4035159 |
0.38 |
|
| 2014 |
Bañuelos JL, Feng G, Fulvio PF, Li S, Rother G, Arend N, Faraone A, Dai S, Cummings PT, Wesolowski DJ. The influence of a hierarchical porous carbon network on the coherent dynamics of a nanoconfined room temperature ionic liquid: A neutron spin echo and atomistic simulation investigation Carbon. 78: 415-427. DOI: 10.1016/J.Carbon.2014.07.020 |
0.37 |
|
| 2013 |
French WR, Pervaje AK, Santos AP, Iacovella CR, Cummings PT. Probing the Statistical Validity of the Ductile-to-Brittle Transition in Metallic Nanowires Using GPU Computing. Journal of Chemical Theory and Computation. 9: 5558-66. PMID 26592289 DOI: 10.1021/Ct400885Z |
0.717 |
|
| 2013 |
French WR, Iacovella CR, Rungger I, Souza AM, Sanvito S, Cummings PT. Structural Origins of Conductance Fluctuations in Gold-Thiolate Molecular Transport Junctions. The Journal of Physical Chemistry Letters. 4: 887-91. PMID 26291351 DOI: 10.1021/Jz4001104 |
0.711 |
|
| 2013 |
Hlushak SP, Cummings PT, McCabe C. Comparison of several classical density functional theories for the adsorption of flexible chain molecules into cylindrical nanopores. The Journal of Chemical Physics. 139: 234902. PMID 24359388 DOI: 10.1063/1.4843655 |
0.328 |
|
| 2013 |
Gai L, Vogel T, Maerzke KA, Iacovella CR, Landau DP, Cummings PT, McCabe C. Examining the phase transition behavior of amphiphilic lipids in solution using statistical temperature molecular dynamics and replica-exchange Wang-Landau methods. The Journal of Chemical Physics. 139: 054505. PMID 23927268 DOI: 10.1063/1.4816520 |
0.357 |
|
| 2013 |
Kalyuzhnyi YV, Marshall BD, Chapman WG, Cummings PT. Second-order resummed thermodynamic perturbation theory for central-force associating potential: multi-patch colloidal models. The Journal of Chemical Physics. 139: 044909. PMID 23902021 DOI: 10.1063/1.4816128 |
0.319 |
|
| 2013 |
Li S, Han KS, Feng G, Hagaman EW, Vlcek L, Cummings PT. Dynamic and structural properties of room-temperature ionic liquids near silica and carbon surfaces. Langmuir : the Acs Journal of Surfaces and Colloids. 29: 9744-9. PMID 23845079 DOI: 10.1021/La401172Z |
0.326 |
|
| 2013 |
French WR, Iacovella CR, Rungger I, Souza AM, Sanvito S, Cummings PT. Atomistic simulations of highly conductive molecular transport junctions under realistic conditions. Nanoscale. 5: 3654-9. PMID 23552959 DOI: 10.1039/C3Nr00459G |
0.687 |
|
| 2013 |
Wu C, Chen M, Skelton AA, Cummings PT, Zheng T. Adsorption of arginine-glycine-aspartate tripeptide onto negatively charged rutile (110) mediated by cations: the effect of surface hydroxylation. Acs Applied Materials & Interfaces. 5: 2567-79. PMID 23461392 DOI: 10.1021/Am3031568 |
0.311 |
|
| 2013 |
Feng G, Li S, Presser V, Cummings PT. Molecular insights into carbon supercapacitors based on room-temperature ionic liquids Journal of Physical Chemistry Letters. 4: 3367-3376. DOI: 10.1021/Jz4014163 |
0.315 |
|
| 2013 |
French WR, Iacovella CR, Rungger I, Souza AM, Sanvito S, Cummings PT. Structural origins of conductance fluctuations in gold-thiolate molecular transport junctions Journal of Physical Chemistry Letters. 4: 887-891. DOI: 10.1021/jz4001104 |
0.66 |
|
| 2013 |
Chialvo AA, Vlcek L, Cummings PT. Surface corrugation effects on the water-graphene interfacial and confinement behavior Journal of Physical Chemistry C. 117: 23875-23886. DOI: 10.1021/Jp408893B |
0.342 |
|
| 2013 |
P?edota M, Machesky ML, Wesolowski DJ, Cummings PT. Electric double layer at the rutile (110) surface. 4. effect of temperature and ph on the adsorption and dynamics of ions Journal of Physical Chemistry C. 117: 22852-22866. DOI: 10.1021/Jp407124P |
0.322 |
|
| 2013 |
Li S, Feng G, Bañuelos JL, Rother G, Fulvio PF, Dai S, Cummings PT. Distinctive nanoscale organization of dicationic versus monocationic ionic liquids Journal of Physical Chemistry C. 117: 18251-18257. DOI: 10.1021/Jp406381G |
0.314 |
|
| 2013 |
Feng G, Li S, Atchison JS, Presser V, Cummings PT. Molecular insights into carbon nanotube supercapacitors: Capacitance independent of voltage and temperature Journal of Physical Chemistry C. 117: 9178-9186. DOI: 10.1021/Jp403547K |
0.302 |
|
| 2013 |
French WR, Pervaje AK, Santos AP, Iacovella CR, Cummings PT. Probing the statistical validity of the ductile-to-brittle transition in metallic nanowires using GPU computing Journal of Chemical Theory and Computation. 9: 5558-5566. DOI: 10.1021/ct400885z |
0.636 |
|
| 2013 |
Li S, Zhao X, Mo Y, Cummings PT, Heller WT. Human serum albumin interactions with C60 fullerene studied by spectroscopy, small-angle neutron scattering, and molecular dynamics simulations Journal of Nanoparticle Research. 15. DOI: 10.1007/S11051-013-1769-0 |
0.404 |
|
| 2013 |
Iacovella CR, Varga G, Sallai J, Mukherjee S, Ledeczi A, Cummings PT. A model-integrated computing approach to nanomaterials simulation Theoretical Chemistry Accounts. 132: 1-9. DOI: 10.1007/S00214-012-1315-7 |
0.318 |
|
| 2012 |
Li S, Feng G, Fulvio PF, Hillesheim PC, Liao C, Dai S, Cummings PT. Molecular Dynamics Simulation Study of the Capacitive Performance of a Binary Mixture of Ionic Liquids near an Onion-like Carbon Electrode. The Journal of Physical Chemistry Letters. 3: 2465-9. PMID 26292134 DOI: 10.1021/Jz3009387 |
0.339 |
|
| 2012 |
Maerzke KA, Gai L, Cummings PT, McCabe C. Incorporating configurational-bias Monte Carlo into the Wang-Landau algorithm for continuous molecular systems. The Journal of Chemical Physics. 137: 204105. PMID 23205979 DOI: 10.1063/1.4766354 |
0.321 |
|
| 2012 |
Gai L, Maerzke K, Cummings PT, McCabe C. A Wang-Landau study of a lattice model for lipid bilayer self-assembly. The Journal of Chemical Physics. 137: 144901. PMID 23061859 DOI: 10.1063/1.4754536 |
0.326 |
|
| 2012 |
Hlushak SP, McCabe C, Cummings PT. Fourier space approach to the classical density functional theory for multi-Yukawa and square-well fluids. The Journal of Chemical Physics. 137: 104104. PMID 22979847 DOI: 10.1063/1.4749381 |
0.313 |
|
| 2012 |
French WR, Iacovella CR, Cummings PT. Large-scale atomistic simulations of environmental effects on the formation and properties of molecular junctions. Acs Nano. 6: 2779-89. PMID 22335340 DOI: 10.1021/Nn300276M |
0.722 |
|
| 2012 |
Wu C, Skelton AA, Chen M, VlÄek L, Cummings PT. Modeling the interaction between integrin-binding peptide (RGD) and rutile surface: the effect of cation mediation on Asp adsorption. Langmuir : the Acs Journal of Surfaces and Colloids. 28: 2799-811. PMID 22220570 DOI: 10.1021/La204329D |
0.306 |
|
| 2012 |
Buenzli PR, Jeon J, Pivonka P, Smith DW, Cummings PT. Investigation of bone resorption within a cortical basic multicellular unit using a lattice-based computational model. Bone. 50: 378-89. PMID 22100414 DOI: 10.1016/J.Bone.2011.10.021 |
0.738 |
|
| 2012 |
Wesolowski DJ, Sofo JO, Bandura AV, Zhang Z, Mamontov E, P?edota M, Kumar N, Kubicki JD, Kent PRC, Vlcek L, MacHesky ML, Fenter PA, Cummings PT, Anovitz LM, Skelton AA, et al. Comment on "structure and dynamics of liquid water on rutile TiO 2(110)" Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.167401 |
0.369 |
|
| 2012 |
Li S, Feng G, Fulvio PF, Hillesheim PC, Liao C, Dai S, Cummings PT. Molecular dynamics simulation study of the capacitive performance of a binary mixture of ionic liquids near an onion-like carbon electrode Journal of Physical Chemistry Letters. 3: 2465-2469. DOI: 10.1021/jz3009387 |
0.329 |
|
| 2012 |
Li S, Bañuelos JL, Guo J, Anovitz L, Rother G, Shaw RW, Hillesheim PC, Dai S, Baker GA, Cummings PT. Alkyl chain length and temperature effects on structural properties of pyrrolidinium-based ionic liquids: A combined atomistic simulation and small-angle x-ray scattering study Journal of Physical Chemistry Letters. 3: 125-130. DOI: 10.1021/Jz2013209 |
0.325 |
|
| 2012 |
Han KS, Li S, Hagaman EW, Baker GA, Cummings P, Dai S. Rotational and translational dynamics of N -butyl- N -methylpiperidinium trifluoromethanesulfonimide ionic liquids studied by NMR and MD simulations Journal of Physical Chemistry C. 116: 20779-20786. DOI: 10.1021/Jp3069283 |
0.32 |
|
| 2012 |
Srivastava R, Singh JK, Cummings PT. Effect of electric field on water confined in graphite and mica pores Journal of Physical Chemistry C. 116: 17594-17603. DOI: 10.1021/Jp304144S |
0.324 |
|
| 2011 |
Iacovella CR, French WR, Cook BG, Kent PR, Cummings PT. Role of polytetrahedral structures in the elongation and rupture of gold nanowires. Acs Nano. 5: 10065-73. PMID 22040227 DOI: 10.1021/Nn203941R |
0.711 |
|
| 2011 |
Skelton AA, Wesolowski DJ, Cummings PT. Investigating the quartz (1010)/water interface using classical and ab initio molecular dynamics. Langmuir : the Acs Journal of Surfaces and Colloids. 27: 8700-9. PMID 21648451 DOI: 10.1021/La2005826 |
0.342 |
|
| 2011 |
Chialvo AA, Cummings PT. Aqua ions-graphene interfacial and confinement behavior: insights from isobaric-isothermal molecular dynamics. The Journal of Physical Chemistry. A. 115: 5918-27. PMID 21491923 DOI: 10.1021/Jp110318N |
0.345 |
|
| 2011 |
Machesky M, Wesolowski D, Rosenqvist J, P?edota M, Vlcek L, Ridley M, Kohli V, Zhang Z, Fenter P, Cummings P, Lvov S, Fedkin M, Rodriguez-Santiago V, Kubicki J, Bandura A. Comparison of cation adsorption by isostructural rutile and cassiterite. Langmuir : the Acs Journal of Surfaces and Colloids. 27: 4585-93. PMID 21417233 DOI: 10.1021/La1040163 |
0.321 |
|
| 2011 |
Fenter P, Lee SS, Skelton AA, Cummings PT. Direct and quantitative comparison of pixelated density profiles with high-resolution X-ray reflectivity data. Journal of Synchrotron Radiation. 18: 257-65. PMID 21335914 DOI: 10.1107/S0909049510040422 |
0.313 |
|
| 2011 |
Tripathi M, Potdar AA, Yamashita H, Weidow B, Cummings PT, Kirchhofer D, Quaranta V. Laminin-332 cleavage by matriptase alters motility parameters of prostate cancer cells. The Prostate. 71: 184-96. PMID 20672321 DOI: 10.1002/Pros.21233 |
0.621 |
|
| 2011 |
Docherty H, Dyer PJ, Cummings PT. The importance of polarisability in the modelling of solubility: Quantifying the effect of charged co-solutes on the solubility of small non-polar solutes Molecular Simulation. 37: 299-309. DOI: 10.1080/08927022.2011.553225 |
0.767 |
|
| 2011 |
Feng G, Cummings PT. Supercapacitor capacitance exhibits oscillatory behavior as a function of nanopore size Journal of Physical Chemistry Letters. 2: 2859-2864. DOI: 10.1021/Jz201312E |
0.301 |
|
| 2011 |
French WR, Iacovella CR, Cummings PT. The influence of molecular adsorption on elongating gold nanowires Journal of Physical Chemistry C. 115: 18422-18433. DOI: 10.1021/Jp203837R |
0.724 |
|
| 2011 |
Srivastava R, Docherty H, Singh JK, Cummings PT. Phase transitions of water in graphite and mica pores Journal of Physical Chemistry C. 115: 12448-12457. DOI: 10.1021/Jp2003563 |
0.36 |
|
| 2011 |
Skelton AA, Fenter P, Kubicki JD, Wesolowski DJ, Cummings PT. Simulations of the quartz(10̄11)/water interface: A comparison of classical force fields, Ab initio molecular dynamics, and x-ray reflectivity experiments Journal of Physical Chemistry C. 115: 2076-2088. DOI: 10.1021/Jp109446D |
0.369 |
|
| 2011 |
Protsykevytch IA, Kalyuzhnyi YV, Cummings PT. Phase behavior of a simple model of ferrocolloidal fluid Chemical Physics Letters. 503: 226-230. DOI: 10.1016/J.Cplett.2011.01.009 |
0.315 |
|
| 2011 |
Kalyuzhnyi YV, Iacovella CR, Docherty H, Holovko M, Cummings PT. Network Forming Fluids: Yukawa Square-Well m-Point Model Journal of Statistical Physics. 145: 481-506. DOI: 10.1007/S10955-011-0264-1 |
0.363 |
|
| 2010 |
Kalyuzhnyi YV, Docherty H, Cummings PT. Resummed thermodynamic perturbation theory for central force associating potential: One-patch model. The Journal of Chemical Physics. 133: 044502. PMID 20687658 DOI: 10.1063/1.3459098 |
0.339 |
|
| 2010 |
Gruver JS, Potdar AA, Jeon J, Sai J, Anderson B, Webb D, Richmond A, Quaranta V, Cummings PT, Chung CY. Bimodal analysis reveals a general scaling law governing nondirected and chemotactic cell motility. Biophysical Journal. 99: 367-76. PMID 20643054 DOI: 10.1016/J.Bpj.2010.03.073 |
0.763 |
|
| 2010 |
Potdar AA, Jeon J, Weaver AM, Quaranta V, Cummings PT. Human mammary epithelial cells exhibit a bimodal correlated random walk pattern. Plos One. 5: e9636. PMID 20224792 DOI: 10.1371/Journal.Pone.0009636 |
0.771 |
|
| 2010 |
Jeon J, Quaranta V, Cummings PT. An off-lattice hybrid discrete-continuum model of tumor growth and invasion. Biophysical Journal. 98: 37-47. PMID 20074513 DOI: 10.1016/J.Bpj.2009.10.002 |
0.751 |
|
| 2010 |
Leng Y, Lei Y, Cummings PT. Comparative studies on the structure and diffusion dynamics of aqueous and nonpolar liquid films under nanometers confinement Modelling and Simulation in Materials Science and Engineering. 18. DOI: 10.1088/0965-0393/18/3/034007 |
0.349 |
|
| 2010 |
Glotzer SC, Fuchs AH, Okazaki S, Moore J, Cummings PT. Molecular Simulation: Foreword Molecular Simulation. 36: 1196. DOI: 10.1080/08927022.2010.534898 |
0.333 |
|
| 2010 |
Pu Q, Leng Y, Zhao X, Cummings PT. Molecular simulation studies on the elongation of gold nanowires in benzenedithiol Journal of Physical Chemistry C. 114: 10365-10372. DOI: 10.1021/Jp101689U |
0.61 |
|
| 2009 |
Rosenqvist J, Machesky ML, Vlcek L, Cummings PT, Wesolowski DJ. Charging properties of cassiterite (alpha-SnO(2)) surfaces in NaCl and RbCl ionic media. Langmuir : the Acs Journal of Surfaces and Colloids. 25: 10852-62. PMID 19673509 DOI: 10.1021/La901396W |
0.321 |
|
| 2009 |
Mamontov E, Vlcek L, Wesolowski DJ, Cummings PT, Rosenqvist J, Wang W, Cole DR, Anovitz LM, Gasparovic G. Suppression of the dynamic transition in surface water at low hydration levels: a study of water on rutile. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 79: 051504. PMID 19518459 DOI: 10.1103/Physreve.79.051504 |
0.356 |
|
| 2009 |
Potdar AA, Lu J, Jeon J, Weaver AM, Cummings PT. Bimodal analysis of mammary epithelial cell migration in two dimensions. Annals of Biomedical Engineering. 37: 230-45. PMID 18982450 DOI: 10.1007/S10439-008-9592-Y |
0.761 |
|
| 2009 |
Redmill PS, Capps SL, Cummings PT, McCabe C. A molecular dynamics study of the Gibbs free energy of solvation of fullerene particles in octanol and water Carbon. 47: 2865-2874. DOI: 10.1016/J.Carbon.2009.06.040 |
0.788 |
|
| 2008 |
Jeon J, Alexander NR, Weaver AM, Cummings PT. Protrusion of a Virtual Model Lamellipodium by Actin Polymerization: A Coarse-grained Langevin Dynamics Model. Journal of Statistical Physics. 133: 79-100. PMID 20351797 DOI: 10.1007/S10955-008-9600-5 |
0.745 |
|
| 2008 |
Koparde VN, Cummings PT. Phase transformations during sintering of titania nanoparticles. Acs Nano. 2: 1620-4. PMID 19206364 DOI: 10.1021/Nn800092M |
0.677 |
|
| 2008 |
Pu Q, Leng Y, Cummings PT. Rate-dependent energy release mechanism of gold nanowires under elongation. Journal of the American Chemical Society. 130: 17907-12. PMID 19063627 DOI: 10.1021/Ja806319G |
0.582 |
|
| 2008 |
Machesky ML, Predota M, Wesolowski DJ, Vlcek L, Cummings PT, Rosenqvist J, Ridley MK, Kubicki JD, Bandura AV, Kumar N, Sofo JO. Surface protonation at the rutile (110) interface: explicit incorporation of solvation structure within the refined MUSIC model framework. Langmuir : the Acs Journal of Surfaces and Colloids. 24: 12331-9. PMID 18842061 DOI: 10.1021/La801356M |
0.708 |
|
| 2008 |
Payne CM, Zhao X, Cummings PT. Electrophoresis of ssDNA through nanoelectrode gaps from molecular dynamics: impact of gap width and chain length. The Journal of Physical Chemistry. B. 112: 12851-8. PMID 18783267 DOI: 10.1021/Jp802258V |
0.588 |
|
| 2008 |
Dyer PJ, Docherty H, Cummings PT. The importance of polarizability in the modeling of solubility: quantifying the effect of solute polarizability on the solubility of small nonpolar solutes in popular models of water. The Journal of Chemical Physics. 129: 024508. PMID 18624539 DOI: 10.1063/1.2953324 |
0.774 |
|
| 2008 |
Hlushak SP, Kalyuzhnyi YV, Cummings PT. Phase coexistence in polydisperse athermal polymer-colloidal mixture. The Journal of Chemical Physics. 128: 154907. PMID 18433277 DOI: 10.1063/1.2907723 |
0.301 |
|
| 2008 |
Payne CM, Zhao X, Vlcek L, Cummings PT. Molecular dynamics simulation of ss-DNA translocation between copper nanoelectrodes incorporating electrode charge dynamics. The Journal of Physical Chemistry. B. 112: 1712-7. PMID 18211061 DOI: 10.1021/Jp077483E |
0.554 |
|
| 2008 |
Wesolowski DJ, Machesky ML, Ridley MK, Palmer DA, Zhang Z, Fenter P, Předota M, Cummings PT. Ion adsorption on metal oxide surfaces to hydrothermal conditions Ecs Transactions. 11: 167-180. DOI: 10.1149/1.2939086 |
0.615 |
|
| 2008 |
Vlček L, Cummings PT. Adsorption of water on TiO2 and SnO2 surfaces: Molecular dynamics study Collection of Czechoslovak Chemical Communications. 73: 575-589. DOI: 10.1135/Cccc20080575 |
0.343 |
|
| 2008 |
Mamontov E, Wesolowski DJ, Vlcek L, Cummings PT, Rosenqvist J, Wang W, Cole DR. Dynamics of hydration water on rutile studied by backscattering neutron spectroscopy and molecular dynamics simulation Journal of Physical Chemistry C. 112: 12334-12341. DOI: 10.1021/Jp711965X |
0.372 |
|
| 2008 |
Zhao X, Payne CM, Cummings PT. Controlled translocation of DNA segments through nanoelectrode gaps from molecular dynamics Journal of Physical Chemistry C. 112: 8-12. DOI: 10.1021/Jp709652Y |
0.561 |
|
| 2008 |
Koparde VN, Cummings PT. Sintering of titanium dioxide nanoparticles: A comparison between molecular dynamics and phenomenological modeling Journal of Nanoparticle Research. 10: 1169-1182. DOI: 10.1007/S11051-007-9342-3 |
0.72 |
|
| 2007 |
Zhao X, Payne CM, Cummings PT, Lee JW. Single-strand DNA molecule translocation through nanoelectrode gaps. Nanotechnology. 18: 424018. PMID 21730451 DOI: 10.1088/0957-4484/18/42/424018 |
0.558 |
|
| 2007 |
Pu Q, Leng Y, Zhao X, Cummings PT. Molecular simulations of stretching gold nanowires in solvents. Nanotechnology. 18: 424007. PMID 21730440 DOI: 10.1088/0957-4484/18/42/424007 |
0.613 |
|
| 2007 |
Striolo A, McCabe C, Cummings PT, Chan ER, Glotzer SC. Aggregation of POSS monomers in liquid hexane: a molecular-simulation study. The Journal of Physical Chemistry. B. 111: 12248-56. PMID 17918877 DOI: 10.1021/Jp071730X |
0.383 |
|
| 2007 |
Chan ER, Striolo A, McCabe C, Cummings PT, Glotzer SC. Coarse-grained force field for simulating polymer-tethered silsesquioxane self-assembly in solution. The Journal of Chemical Physics. 127: 114102. PMID 17887823 DOI: 10.1063/1.2753493 |
0.338 |
|
| 2007 |
Pu Q, Leng Y, Tsetseris L, Park HS, Pantelides ST, Cummings PT. Molecular dynamics simulations of stretched gold nanowires: the relative utility of different semiempirical potentials. The Journal of Chemical Physics. 126: 144707. PMID 17444732 DOI: 10.1063/1.2717162 |
0.596 |
|
| 2007 |
Vlcek L, Zhang Z, Machesky ML, Fenter P, Rosenqvist J, Wesolowski DJ, Anovitz LM, Predota M, Cummings PT. Electric double layer at metal oxide surfaces: static properties of the cassiterite-water interface. Langmuir : the Acs Journal of Surfaces and Colloids. 23: 4925-37. PMID 17381142 DOI: 10.1021/La063306D |
0.705 |
|
| 2007 |
Kalyuzhnyi YV, Protsykevitch IA, Cummings PT. Liqud-gas phase behavior of Stockmayer fluid with high dipolar moment Condensed Matter Physics. 10: 553-562. DOI: 10.5488/Cmp.10.4.553 |
0.319 |
|
| 2007 |
Kalyuzhnyi YV, Protsykevytch IA, Cummings PT. Thermodynamic properties and liquid-gas phase diagram of the dipolar hard-sphere fluid Epl. 80. DOI: 10.1209/0295-5075/80/56002 |
0.311 |
|
| 2007 |
Tao Z, Cummings PT. Molecular dynamics simulation of inorganic ions in PEO aqueous solution Molecular Simulation. 33: 1255-1260. DOI: 10.1080/08927020701697691 |
0.332 |
|
| 2007 |
McCabe C, Golab JT, Cummings PT. Third Foundations of Molecular Modeling and Simulation Conference FOMMS 2006 Molecular Simulation. 33: 277. DOI: 10.1080/08927020701236995 |
0.352 |
|
| 2007 |
Payne CM, Zhao X, Cummings PT. Molecular simulations of DNA transport in solution Molecular Simulation. 33: 399-403. DOI: 10.1080/08927020601154355 |
0.58 |
|
| 2007 |
McCabe C, Golab JT, Cummings PT. Third Foundations of Molecular Modeling and Simulation conference FOMMS 2006 Molecular Physics. 105: 137. DOI: 10.1080/00268970701227903 |
0.352 |
|
| 2007 |
Leng YS, Dyer PJ, Krstic PS, Harrison RJ, Cummings PT. Calibration of chemical bonding between benzenedithiolate and gold: The effects of geometry and size of gold clusters Molecular Physics. 105: 293-300. DOI: 10.1080/00268970601149298 |
0.757 |
|
| 2007 |
Mamontov E, Vlcek L, Wesolowski DJ, Cummings PT, Wang W, Anovitz LM, Rosenqvist J, Brown CM, Sakai VG. Dynamics and structure of hydration water on rutile and cassiterite nanopowders studied by quasielastic neutron scattering and molecular dynamics simulations Journal of Physical Chemistry C. 111: 4328-4341. DOI: 10.1021/Jp067242R |
0.369 |
|
| 2007 |
Koparde VN, Cummings PT. Molecular dynamics study of water adsorption on TiO2 nanoparticles Journal of Physical Chemistry C. 111: 6920-6926. DOI: 10.1021/Jp0666380 |
0.705 |
|
| 2007 |
Předota M, Cummings PT, Wesolowski DJ. Electric double layer at the rutile (110) surface. 3. Inhomogeneous viscosity and diffusivity measurement by computer simulations Journal of Physical Chemistry C. 111: 3071-3079. DOI: 10.1021/Jp065165U |
0.708 |
|
| 2007 |
Kalyuzhnyi YV, Vlachy V, Cummings PT. Modeling solution of flexible polyelectrolyte in explicit solvent Chemical Physics Letters. 438: 238-243. DOI: 10.1016/J.Cplett.2007.03.028 |
0.332 |
|
| 2007 |
Chialvo AA, Cummings PT. Molecular‐Based Modeling of Water and Aqueous Solutions at Supercritical Conditions Advances in Chemical Physics. 109: 115-205. DOI: 10.1002/9780470141687.Ch3 |
0.302 |
|
| 2006 |
Dyer PJ, Cummings PT. Hydrogen bonding and induced dipole moments in water: predictions from the Gaussian charge polarizable model and Car-Parrinello molecular dynamics. The Journal of Chemical Physics. 125: 144519. PMID 17042621 DOI: 10.1063/1.2355485 |
0.777 |
|
| 2006 |
Striolo A, McCabe C, Cummings PT. Organic-inorganic telechelic molecules: solution properties from simulations. The Journal of Chemical Physics. 125: 104904. PMID 16999547 DOI: 10.1063/1.2348641 |
0.352 |
|
| 2006 |
Leng Y, Cummings PT. Shear dynamics of hydration layers. The Journal of Chemical Physics. 125: 104701. PMID 16999542 DOI: 10.1063/1.2335844 |
0.324 |
|
| 2006 |
Rivera JL, Starr FW, Paricaud P, Cummings PT. Polarizable contributions to the surface tension of liquid water. The Journal of Chemical Physics. 125: 094712. PMID 16965110 DOI: 10.1063/1.2345063 |
0.37 |
|
| 2006 |
Zhao X, Leng Y, Cummings PT. Self-assembly of 1,4-benzenedithiolate/tetrahydrofuran on a gold surface: a Monte Carlo simulation study. Langmuir : the Acs Journal of Surfaces and Colloids. 22: 4116-24. PMID 16618153 DOI: 10.1021/La0532252 |
0.348 |
|
| 2006 |
Kalyuzhnyi YV, Cummings PT. Solution of the mean spherical approximation for polydisperse multi-Yukawa hard-sphere fluid mixture using orthogonal polynomial expansions. The Journal of Chemical Physics. 124: 114509. PMID 16555903 DOI: 10.1063/1.2176677 |
0.325 |
|
| 2006 |
Leng Y, Cummings PT. Hydration structure of water confined between mica surfaces. The Journal of Chemical Physics. 124: 74711. PMID 16497074 DOI: 10.1063/1.2172589 |
0.366 |
|
| 2006 |
Striolo A, Chialvo AA, Cummings PT, Gubbins KE. Simulated water adsorption in chemically heterogeneous carbon nanotubes. The Journal of Chemical Physics. 124: 74710. PMID 16497073 DOI: 10.1063/1.2171349 |
0.311 |
|
| 2006 |
Ionescu TC, Qi F, McCabe C, Striolo A, Kieffer J, Cummings PT. Evaluation of force fields for molecular simulation of polyhedral oligomeric silsesquioxanes. The Journal of Physical Chemistry. B. 110: 2502-10. PMID 16471847 DOI: 10.1021/Jp052707J |
0.32 |
|
| 2005 |
Rivera JL, McCabe C, Cummings PT. The oscillatory damped behaviour of incommensurate double-walled carbon nanotubes. Nanotechnology. 16: 186-98. PMID 21727422 DOI: 10.1088/0957-4484/16/2/003 |
0.323 |
|
| 2005 |
Naicker PK, Cummings PT, Zhang H, Banfield JF. Characterization of titanium dioxide nanoparticles using molecular dynamics simulations. The Journal of Physical Chemistry. B. 109: 15243-9. PMID 16852930 DOI: 10.1021/Jp050963Q |
0.337 |
|
| 2005 |
Striolo A, McCabe C, Cummings PT. Thermodynamic and transport properties of polyhedral oligomeric sislesquioxanes in poly(dimethylsiloxane). The Journal of Physical Chemistry. B. 109: 14300-7. PMID 16852797 DOI: 10.1021/Jp045388P |
0.327 |
|
| 2005 |
Kalyuzhnyi YV, Kahl G, Cummings PT. Phase coexistence in a polydisperse charged hard-sphere fluid: polymer mean spherical approximation. The Journal of Chemical Physics. 123: 124501. PMID 16392492 DOI: 10.1063/1.2042347 |
0.323 |
|
| 2005 |
Koparde VN, Cummings PT. Molecular dynamics simulation of titanium dioxide nanoparticle sintering. The Journal of Physical Chemistry. B. 109: 24280-7. PMID 16375425 DOI: 10.1021/Jp054667P |
0.702 |
|
| 2005 |
Leng Y, Krsti? PS, Wells JC, Cummings PT, Dean DJ. Interaction between benzenedithiolate and gold: classical force field for chemical bonding. The Journal of Chemical Physics. 122: 244721. PMID 16035807 DOI: 10.1063/1.1942468 |
0.349 |
|
| 2005 |
Paricaud P, Predota M, Chialvo AA, Cummings PT. From dimer to condensed phases at extreme conditions: accurate predictions of the properties of water by a Gaussian charge polarizable model. The Journal of Chemical Physics. 122: 244511. PMID 16035786 DOI: 10.1063/1.1940033 |
0.713 |
|
| 2005 |
Striolo A, Chialvo AA, Gubbins KE, Cummings PT. Water in carbon nanotubes: adsorption isotherms and thermodynamic properties from molecular simulation. The Journal of Chemical Physics. 122: 234712. PMID 16008478 DOI: 10.1063/1.1924697 |
0.336 |
|
| 2005 |
Leng Y, Cummings PT. Fluidity of hydration layers nanoconfined between mica surfaces. Physical Review Letters. 94: 026101. PMID 15698197 DOI: 10.1103/Physrevlett.94.026101 |
0.367 |
|
| 2005 |
Kalyuzhnyi YV, Kahl G, Cummings PT. Towards the phase diagram of a polydisperse mixture of charged hard spheres Europhysics Letters. 72: 96-102. DOI: 10.1209/Epl/I2005-10202-4 |
0.318 |
|
| 2005 |
Striolo A, McCabe C, Cummings PT. Effective interactions between polyhedral oligomeric sislesquioxanes dissolved in normal hexadecane from molecular simulation Macromolecules. 38: 8950-8959. DOI: 10.1021/Ma0512859 |
0.357 |
|
| 2005 |
Striolo A, Naicker PK, Chialvo AA, Cummings PT, Gubbins KE. Simulated water adsorption isotherms in hydrophilic and hydrophobic cylindrical nanopores Adsorption. 11: 397-401. DOI: 10.1007/S10450-005-5957-9 |
0.309 |
|
| 2005 |
Striolo A, Gubbins KE, Chialvo AA, Cummings PT. The effect of pore connectivity on water adsorption isotherms in non-activated graphitic nanopores Adsorption. 11: 337-341. DOI: 10.1007/S10450-005-5947-Y |
0.311 |
|
| 2005 |
Koparde VN, Cummings PT. Computer simulations of nanoparticle sintering 2005 Nsti Nanotechnology Conference and Trade Show - Nsti Nanotech 2005 Technical Proceedings. 538-541. |
0.656 |
|
| 2005 |
Redmill PS, Striolo A, McCabe C, Cummings PT. Determining the octanol-water partition coefficient for poss systems Aiche Annual Meeting, Conference Proceedings. 13631. |
0.756 |
|
| 2005 |
Dyer PJ, Cummings PT. Solvation study using gaussian charges particles and GCPM water model Aiche Annual Meeting, Conference Proceedings. 10208. |
0.745 |
|
| 2005 |
Koparde VN, Cummings PT. Molecular dynamics simulation of titania nanoparticles Aiche Annual Meeting, Conference Proceedings. 3022-3023. |
0.677 |
|
| 2004 |
Zhang Z, Fenter P, Cheng L, Sturchio NC, Bedzyk MJ, Predota M, Bandura A, Kubicki JD, Lvov SN, Cummings PT, Chialvo AA, Ridley MK, Bénézeth P, Anovitz L, Palmer DA, et al. Ion adsorption at the rutile-water interface: linking molecular and macroscopic properties. Langmuir : the Acs Journal of Surfaces and Colloids. 20: 4954-69. PMID 15984256 DOI: 10.1021/La0353834 |
0.715 |
|
| 2004 |
Kalyuzhnyi YV, McCabe C, Whitebay E, Cummings PT. Equation of state and liquid-vapor equilibria of one- and two-Yukawa hard-sphere chain fluids: theory and simulation. The Journal of Chemical Physics. 121: 8128-37. PMID 15485277 DOI: 10.1063/1.1798054 |
0.315 |
|
| 2004 |
Kalyuzhnyi YV, Kahl G, Cummings PT. Phase coexistence in polydisperse charged hard-sphere fluids: mean spherical approximation. The Journal of Chemical Physics. 120: 10133-45. PMID 15268036 DOI: 10.1063/1.1737291 |
0.322 |
|
| 2004 |
Cummings PT, Jackson G. Foundations of molecular modelling and simulation FOMMS 2003 Keystone resort, Colorado, USA 6-11 july 2003 Molecular Physics. 102: 137. DOI: 10.1080/00268970410001697299 |
0.352 |
|
| 2004 |
Striolo A, Gubbins KE, Chialvo AA, Cummings PT. Simulated water adsorption isotherms in carbon nanopores Molecular Physics. 102: 243-251. DOI: 10.1080/00268970410001668507 |
0.311 |
|
| 2004 |
Předota M, Zhang Z, Fenter P, Wesolowski DJ, Cummings PT. Electric double layer at the rutile (110) surface. 2. Adsorption of ions from molecular dynamics and X-ray experiments Journal of Physical Chemistry B. 108: 12061-12072. DOI: 10.1021/Jp037199X |
0.691 |
|
| 2004 |
Předota M, Bandura AV, Cummings PT, Kubicki JD, Wesolowski DJ, Chialvo AA, Machesky ML. Electric double layer at the rutile (110) surface. 1. Structure of surfaces and interfacial water from molecular dynamics by use of ab initio potentials Journal of Physical Chemistry B. 108: 12049-12060. DOI: 10.1021/Jp037197C |
0.71 |
|
| 2004 |
Lee MJ, McCabe C, Cummings PT. Square-well chain molecules: A semi-empirical equation of state and Monte Carlo simulation data Fluid Phase Equilibria. 221: 63-72. DOI: 10.1016/J.Fluid.2004.03.008 |
0.336 |
|
| 2003 |
Chen KC, Ford RM, Cummings PT. Cell balance equation for chemotactic bacteria with a biphasic tumbling frequency. Journal of Mathematical Biology. 47: 518-46. PMID 14618378 DOI: 10.1007/S00285-003-0216-8 |
0.545 |
|
| 2003 |
Rivera JL, McCabe C, Cummings PT. Molecular simulations of liquid-liquid interfacial properties: water-n-alkane and water-methanol-n-alkane systems. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 67: 011603. PMID 12636510 DOI: 10.1103/Physreve.67.011603 |
0.365 |
|
| 2003 |
Pàmies JC, McCabe C, Cummings PT, Vega LF. Coexistence densities of methane and propane by canonical molecular dynamics and Gibbs ensemble Monte Carlo simulations Molecular Simulation. 29: 463-470. DOI: 10.1080/0892702031000117270 |
0.377 |
|
| 2003 |
Peltz C, Baranyai A, Chialvo AA, Cummings PT. Microstructure of water at the level of three-particle correlation functions as predicted by classical intermolecular models Molecular Simulation. 29: 13-21. DOI: 10.1080/0892702031000065692 |
0.343 |
|
| 2003 |
LI H, MCCABE C, CUI ST, CUMMINGS PT, COCHRAN HD. On the development of a general force field for the molecular simulation of perfluoroethers Molecular Physics. 101: 2157-2169. DOI: 10.1080/0026897031000154329 |
0.336 |
|
| 2003 |
Cui ST, McCabe C, Cummings PT, Cochran HD. Molecular dynamics study of the nano-rheology ofn-dodecane confined between planar surfaces The Journal of Chemical Physics. 118: 8941-8944. DOI: 10.1063/1.1568084 |
0.356 |
|
| 2003 |
Kalyuzhnyi YV, Cummings PT. Yukawa sticky m-point model of associating fluid The Journal of Chemical Physics. 118: 6437-6445. DOI: 10.1063/1.1559032 |
0.348 |
|
| 2003 |
Striolo A, Chialvo AA, Cummings PT, Gubbins KE. Water Adsorption in Carbon-Slit Nanopores Langmuir. 19: 8583-8591. DOI: 10.1021/La0347354 |
0.304 |
|
| 2003 |
McCabe C, Galindo A, Cummings PT. Anomalies in the Solubility of Alkanes in Near-Critical Water The Journal of Physical Chemistry B. 107: 12307-12314. DOI: 10.1021/Jp0352332 |
0.37 |
|
| 2003 |
Leng Y, Keffer DJ, Cummings PT. Structure and Dynamics of a Benzenedithiol Monolayer on a Au(111) Surface Journal of Physical Chemistry B. 107: 11940-11950. DOI: 10.1021/Jp034405S |
0.386 |
|
| 2003 |
McCabe C, Bedrov D, Borodin O, Smith GD, Cummings PT. Transport Properties of Perfluoroalkanes Using Molecular Dynamics Simulation: Comparison of United- and Explicit-Atom Models Industrial and Engineering Chemistry Research. 42: 6956-6961. DOI: 10.1021/Ie034012F |
0.328 |
|
| 2003 |
Krstić PS, Dean DJ, Zhang XG, Keffer D, Leng YS, Cummings PT, Wells JC. Computational chemistry for molecular electronics Computational Materials Science. 28: 321-341. DOI: 10.1016/S0927-0256(03)00116-2 |
0.357 |
|
| 2003 |
Chialvo AA, Cummings PT, Simonson JM. H3O+/CI− ion pairing in hydrothermal solutions by simulation and electrical conductance. A review Journal of Molecular Liquids. 235-248. DOI: 10.1016/S0167-7322(02)00143-5 |
0.301 |
|
| 2003 |
Jin M, Ford RM, Cummings PT. A numerical method for solving a scalar advection-dominated transport equation with concentration-dependent sources Computers and Chemical Engineering. 27: 1405-1419. DOI: 10.1016/S0098-1354(03)00008-5 |
0.508 |
|
| 2002 |
Bair S, McCabe C, Cummings PT. Comparison of nonequilibrium molecular dynamics with experimental measurements in the nonlinear shear-thinning regime. Physical Review Letters. 88: 058302. PMID 11863785 DOI: 10.1103/Physrevlett.88.058302 |
0.325 |
|
| 2002 |
PŘEDOTA M, CUMMINGS PT, CHIALVO AA. Pair approximation for polarization interaction and adiabatic nuclear and electronic sampling method for fluids with dipole polarizability Molecular Physics. 100: 2703-2717. DOI: 10.1080/00268970210137284 |
0.69 |
|
| 2002 |
Kalyuzhnyi YV, McCabe C, Cummings PT, Stell G. Structural and thermodynamic properties of a multicomponent freely jointed hard sphere multi-Yukawa chain fluid Molecular Physics. 100: 2499-2517. DOI: 10.1080/00268970210130245 |
0.352 |
|
| 2002 |
PŘEDOTA M, NEZBEDA I, CUMMINGS PT. Hydrophobic hydration at the level of primitive models. II: Large solutes and water restructuring Molecular Physics. 100: 2189-2200. DOI: 10.1080/00268970210124800 |
0.755 |
|
| 2002 |
LI H, MCCABEL C, CUI ST, CUMMINGS PT, COCHRAN HD. Development of a force field for molecular simulation of the phase equilibria of perfluoromethylpropyl ether Molecular Physics. 100: 265-272. DOI: 10.1080/00268970110086336 |
0.376 |
|
| 2002 |
McCabe C, Manke CW, Cummings PT. Predicting the Newtonian viscosity of complex fluids from high strain rate molecular simulations Journal of Chemical Physics. 116: 3339-3342. DOI: 10.1063/1.1446045 |
0.311 |
|
| 2002 |
Bair S, McCabe C, Cummings PT. Calculation of viscous EHL traction for squalane using molecular simulation and rheometry Tribology Letters. 13: 251-254. DOI: 10.1023/A:1021011225316 |
0.359 |
|
| 2002 |
Yezdimer EM, Cummings PT, Chialvo AA. Determination of the Gibbs Free Energy of Gas Replacement in SI Clathrate Hydrates by Molecular Simulation The Journal of Physical Chemistry A. 106: 7982-7987. DOI: 10.1021/Jp020795R |
0.327 |
|
| 2002 |
Kettler M, Nezbeda I, Chialvo AA, Cummings PT. Effect of the Range of Interactions on the Properties of Fluids. Phase Equilibria in Pure Carbon Dioxide, Acetone, Methanol, and Water The Journal of Physical Chemistry B. 106: 7537-7546. DOI: 10.1021/Jp020139R |
0.586 |
|
| 2002 |
Chialvo AA, Houssa M, Cummings PT. Molecular Dynamics Study of the Structure and Thermophysical Properties of Model sI Clathrate Hydrates The Journal of Physical Chemistry B. 106: 442-451. DOI: 10.1021/Jp012735B |
0.393 |
|
| 2002 |
Furukawa S, McCabe C, Nitta T, Cummings PT. Non-equilibrium molecular dynamics simulation study of the behavior of hydrocarbon-isomers in silicalite Fluid Phase Equilibria. 194: 309-317. DOI: 10.1016/S0378-3812(01)00670-7 |
0.353 |
|
| 2002 |
McCabe C, Kalyuzhnyi YV, Cummings PT. Thermodynamic properties of freely-jointed hard-sphere multi-Yukawa chain fluids: theory and simulation Fluid Phase Equilibria. 194: 185-196. DOI: 10.1016/S0378-3812(01)00661-6 |
0.341 |
|
| 2002 |
Rivera J, Predota M, Chialvo A, Cummings P. Vapor–liquid equilibrium simulations of the SCPDP model of water Chemical Physics Letters. 357: 189-194. DOI: 10.1016/S0009-2614(02)00527-4 |
0.718 |
|
| 2001 |
Lee SH, Cummings PT. Molecular Dynamics Simulation of Limiting Conductance for Na2+, Cl2−, Na°, and Cl° in Supercritical Water Molecular Simulation. 27: 199-213. DOI: 10.1080/08927020108027947 |
0.352 |
|
| 2001 |
KIM S, CUMMINGS PT. Adsorption isotherm of a Lennard-Jones nitrogen in a carbon slitlike pore Molecular Physics. 99: 1099-1105. DOI: 10.1080/00268970110041227 |
0.333 |
|
| 2001 |
PŘEDOTA M, CUMMINGS PT, CHIALVO AA. Pair approximation for polarization interaction: efficient method for Monte Carlo simulations of polarizable fluids Molecular Physics. 99: 349-354. DOI: 10.1080/00268970010012338 |
0.705 |
|
| 2001 |
Kalyuzhnyi YV, Cummings PT. Multicomponent mixture of charged hard-sphere chain molecules in the polymer mean-spherical approximation The Journal of Chemical Physics. 115: 540-551. DOI: 10.1063/1.1376426 |
0.341 |
|
| 2001 |
Chialvo AA, Simonson JM, Cummings PT, Kusalik PG. On the determination of orientational configurational temperature from computer simulation Journal of Chemical Physics. 114: 6514-6517. DOI: 10.1063/1.1357792 |
0.332 |
|
| 2001 |
Cui ST, Cummings PT, Cochran HD. Effect of branches on the structure of narrowly confined alkane fluids: n-hexadecane and 2,6,11,15-tetramethylhexadecane The Journal of Chemical Physics. 114: 6464-6471. DOI: 10.1063/1.1357200 |
0.331 |
|
| 2001 |
Chialvo AA, Kusalik PG, Cummings PT, Simonson JM. Solvation in high-temperature electrolyte solutions. III. Integral equation calculations and interpretation of experimental data Journal of Chemical Physics. 114: 3575-3585. DOI: 10.1063/1.1343875 |
0.326 |
|
| 2001 |
McCabe C, Cui S, Cummings PT, Gordon PA, Saeger RB. Examining the rheology of 9-octylheptadecane to giga-pascal pressures The Journal of Chemical Physics. 114: 1887-1891. DOI: 10.1063/1.1334676 |
0.367 |
|
| 2001 |
Salaniwal S, Cui ST, Cochran HD, Cummings PT. Molecular Simulation of a Dichain Surfactant/Water/Carbon Dioxide System. 2. Self-Assembly and Aggregation Dynamics Langmuir. 17: 1784-1792. DOI: 10.1021/La0005558 |
0.312 |
|
| 2001 |
Salaniwal S, Cui ST, Cochran HD, Cummings PT. Molecular Simulation of a Dichain Surfactant/Water/Carbon Dioxide System. 1. Structural Properties of Aggregates Langmuir. 17: 1773-1783. DOI: 10.1021/La000554F |
0.395 |
|
| 2001 |
Yezdimer EM, Chialvo AA, Cummings PT. Examination of Chain Length Effects on the Solubility of Alkanes in Near-Critical and Supercritical Aqueous Solutions The Journal of Physical Chemistry B. 105: 841-847. DOI: 10.1021/Jp002610R |
0.356 |
|
| 2001 |
McCabe C, Bedrov D, Smith GD, Cummings PT. Discriminating between Correlations of Experimental Viscosity Data for Perfluorobutane Using Molecular Simulation Industrial & Engineering Chemistry Research. 40: 473-475. DOI: 10.1021/Ie000659D |
0.356 |
|
| 2001 |
Cui ST, Cummings PT, Cochran HD. Structural transition and solid-like behavior of alkane films confined in nano-spacing Fluid Phase Equilibria. 183: 381-387. DOI: 10.1016/S0378-3812(01)00450-2 |
0.34 |
|
| 2001 |
McCabe C, Cui S, Cummings PT. Characterizing the viscosity–temperature dependence of lubricants by molecular simulation Fluid Phase Equilibria. 183: 363-370. DOI: 10.1016/S0378-3812(01)00448-4 |
0.331 |
|
| 2001 |
Předota M, Chialvo AA, Cummings PT. On the determination of the vapor–liquid envelope for polarizable models by Monte Carlo simulation Fluid Phase Equilibria. 183: 295-300. DOI: 10.1016/S0378-3812(01)00441-1 |
0.368 |
|
| 2001 |
Yezdimer EM, Chialvo AA, Cummings PT. Chain length effects on aqueous alkane solubility near the solvent’s critical point Fluid Phase Equilibria. 183: 289-294. DOI: 10.1016/S0378-3812(01)00440-X |
0.333 |
|
| 2000 |
Chialvo AA, Kusalik PG, Cummings PT, Simonson JM, Mesmer RE. Molecular approach to high-temperature solvation. Formal, integral equation and experimental results Journal of Physics Condensed Matter. 12: 3585-3593. DOI: 10.1088/0953-8984/12/15/307 |
0.31 |
|
| 2000 |
Lee SH, Cummings PT. Molecular dynamics simulation of limiting conductances for LiCl, NaBr, and CsBr in supercritical water The Journal of Chemical Physics. 112: 864-869. DOI: 10.1063/1.480613 |
0.364 |
|
| 2000 |
Baranyai A, Cummings PT. Liquid–vapor coexistence by molecular dynamics simulation The Journal of Chemical Physics. 112: 3516-3522. DOI: 10.1063/1.480506 |
0.366 |
|
| 2000 |
Moore JD, Cui ST, Cochran HD, Cummings PT. Rheology of lubricant basestocks: A molecular dynamics study of C30 isomers The Journal of Chemical Physics. 113: 8833-8840. DOI: 10.1063/1.1318768 |
0.359 |
|
| 2000 |
Chialvo AA, Cummings PT, Simonson JM. H3O+/Cl− ion-pair formation in high-temperature aqueous solutions The Journal of Chemical Physics. 113: 8093-8100. DOI: 10.1063/1.1314869 |
0.352 |
|
| 2000 |
Chialvo AA, Kusalik PG, Kalyuzhnyi YV, Cummings PT. Journal of Statistical Physics. 100: 167-199. DOI: 10.1023/A:1018639728431 |
0.316 |
|
| 2000 |
Salaniwal S, Cui S, Cochran HD, Cummings PT. Molecular Dynamics Simulation of Reverse Micelles in Supercritical Carbon Dioxide Industrial & Engineering Chemistry Research. 39: 4543-4554. DOI: 10.1021/Ie000144M |
0.365 |
|
| 2000 |
Moore J, Cui S, Cochran H, Cummings P. A molecular dynamics study of a short-chain polyethylene melt. Journal of Non-Newtonian Fluid Mechanics. 93: 101-116. DOI: 10.1016/S0377-0257(00)00104-X |
0.301 |
|
| 2000 |
Moore J, Cui S, Cochran H, Cummings P. A molecular dynamics study of a short-chain polyethylene melt. Journal of Non-Newtonian Fluid Mechanics. 93: 83-99. DOI: 10.1016/S0377-0257(00)00103-8 |
0.319 |
|
| 2000 |
Chialvo A, Cummings P, Simonson J, Mesme R. Solvation in high-temperature aqueous electrolyte solutions Journal of Molecular Liquids. 87: 233-242. DOI: 10.1016/S0167-7322(00)00123-9 |
0.301 |
|
| 1999 |
NEZBEDA I, CUMMINGS PT. Fifth Liblice Conference on the Statistical Mechanics of Liquids (June 7–12, 1998, [Zcirc]elezná Ruda, Šumava National Park, Czech Republic) Molecular Physics. 96: 1583-1585. DOI: 10.1080/00268979909483100 |
0.505 |
|
| 1999 |
YEZDIMER EM, CUMMINGS PT. Calculation of the vapour-liquid coexistence curve for a fluctuating point charge water model Molecular Physics. 97: 993-996. DOI: 10.1080/00268979909482901 |
0.347 |
|
| 1999 |
Driesner T, Cummings PT. Molecular simulation of the temperature- and density-dependence of ionic hydration in aqueous SrCl2 solutions using rigid and flexible water models The Journal of Chemical Physics. 111: 5141-5149. DOI: 10.1063/1.479769 |
0.408 |
|
| 1999 |
Chialvo AA, Cummings PT, Simonson JM, Mesmer RE. Solvation in high-temperature electrolyte solutions. II. Some formal results The Journal of Chemical Physics. 110: 1075-1086. DOI: 10.1063/1.478151 |
0.316 |
|
| 1999 |
Chialvo AA, Cummings PT, Simonson JM, Mesmer RE. Solvation in high-temperature electrolyte solutions. I. Hydration shell behavior from molecular simulation The Journal of Chemical Physics. 110: 1064-1074. DOI: 10.1063/1.478150 |
0.37 |
|
| 1999 |
Baranyai A, Cummings PT. Steady state simulation of planar elongation flow by nonequilibrium molecular dynamics The Journal of Chemical Physics. 110: 42-45. DOI: 10.1063/1.478082 |
0.325 |
|
| 1999 |
Salaniwal S, Cui ST, Cummings PT, Cochran HD. Self-Assembly of Reverse Micelles in Water/Surfactant/Carbon Dioxide Systems by Molecular Simulation Langmuir. 15: 5188-5192. DOI: 10.1021/La9904556 |
0.337 |
|
| 1999 |
Borzsák I, Cummings PT. Molecular dynamics simulation of ice XII Chemical Physics Letters. 300: 359-363. DOI: 10.1016/S0009-2614(98)01387-6 |
0.364 |
|
| 1999 |
Chen KC, Ford RM, Cummings PT. Spatial effect of tumbling frequencies for motile bacteria on cell balance equations Chemical Engineering Science. 54: 593-617. DOI: 10.1016/S0009-2509(98)00268-1 |
0.536 |
|
| 1998 |
Chen KC, Ford RM, Cummings PT. Mathematical models for motile bacterial transport in cylindrical tubes. Journal of Theoretical Biology. 195: 481-504. PMID 9837704 DOI: 10.1006/Jtbi.1998.0808 |
0.549 |
|
| 1998 |
Chen KC, Ford RM, Cummings PT. The global turning probability density function for motile bacteria and its applications. Journal of Theoretical Biology. 195: 139-55. PMID 9822560 DOI: 10.1006/Jtbi.1998.0768 |
0.528 |
|
| 1998 |
Chen KC, Cummings PT, Ford RM. Perturbation Expansion of Alt's Cell Balance Equations Reduces to Segel's One-Dimensional Equations for Shallow Chemoattractant Gradients Siam Journal On Applied Mathematics. 59: 35-57. DOI: 10.1137/S0036139996301283 |
0.533 |
|
| 1998 |
Lee SH, Cummings PT. The Rheology ofn-Decane and 4-Propyl Heptane by Non Equilibrium Molecular Dynamics Simulations Molecular Simulation. 21: 27-39. DOI: 10.1080/08927029808022048 |
0.374 |
|
| 1998 |
Herrera JN, Blum L, Cummings PT. Thermodynamic properties of an asymmetric fluid mixture with adhesive hard sphere Yukawa interaction in the mean spherical approximation Molecular Physics. 93: 73-78. DOI: 10.1080/002689798169447 |
0.322 |
|
| 1998 |
Cui ST, Cummings PT, Cochran HD. The calculation of viscosity of liquid n-decane and n-hexadecane by the Green-Kubo method Molecular Physics. 93: 117-122. DOI: 10.1080/00268979809482195 |
0.325 |
|
| 1998 |
Cui ST, Cummings PT, Cochran HD, Moore JD, Gupta SA. International Journal of Thermophysics. 19: 449-459. DOI: 10.1023/A:1022565427881 |
0.331 |
|
| 1998 |
Chialvo AA, Cummings PT, Simonson JM, Mesmer RE, Cochran HD. Interplay between Molecular Simulation and Neutron Scattering in Developing New Insights into the Structure of Water† Industrial & Engineering Chemistry Research. 37: 3021-3025. DOI: 10.1021/Ie970903+ |
0.328 |
|
| 1998 |
Cochran H, Cummings P, Cui S, Gupta S, Bhupathiraju R, LoCascio P. Classical molecular simulations of complex, industrially-important systems on the intel paragon Computers & Mathematics With Applications. 35: 73-84. DOI: 10.1016/S0898-1221(98)00034-0 |
0.371 |
|
| 1998 |
Borzsák I, Cummings PT. Effect of oscillatory shear on the fluid–solid phase transition of supercooled water Fluid Phase Equilibria. 150: 141-149. DOI: 10.1016/S0378-3812(98)00285-4 |
0.31 |
|
| 1998 |
Gupta SA, Cochran HD, Cummings PT. Nanorheology of liquid alkanes Fluid Phase Equilibria. 150: 125-131. DOI: 10.1016/S0378-3812(98)00283-0 |
0.333 |
|
| 1998 |
Chialvo AA, Cummings PT, Simonson JM, Mesmer RE. Thermodynamics and kinetics of ion speciation in supercritical aqueous solutions: A molecular based study Fluid Phase Equilibria. 150: 107-115. DOI: 10.1016/S0378-3812(98)00281-7 |
0.318 |
|
| 1998 |
Chialvo AA, Cummings PT. Simple transferable intermolecular potential for the molecular simulation of water over wide ranges of state conditions Fluid Phase Equilibria. 150: 73-81. DOI: 10.1016/S0378-3812(98)00277-5 |
0.347 |
|
| 1998 |
Kofke DA, Cummings PT. Precision and accuracy of staged free-energy perturbation methods for computing the chemical potential by molecular simulation Fluid Phase Equilibria. 150: 41-49. DOI: 10.1016/S0378-3812(98)00274-X |
0.317 |
|
| 1998 |
Cui S, Siepmann J, Cochran H, Cummings P. Intermolecular potentials and vapor–liquid phase equilibria of perfluorinated alkanes Fluid Phase Equilibria. 146: 51-61. DOI: 10.1016/S0378-3812(98)00216-7 |
0.337 |
|
| 1998 |
Cummings PT. Molecular simulation of complex systems using massively parallel supercomputers Fluid Phase Equilibria. 144: 331-342. DOI: 10.1016/S0378-3812(97)00277-X |
0.337 |
|
| 1998 |
Sarman SS, Evans DJ, Cummings PT. Recent developments in non-Newtonian molecular dynamics Physics Reports. 305: 1-92. DOI: 10.1016/S0370-1573(98)00018-0 |
0.357 |
|
| 1998 |
Lee S, Cummings P, Simonson J, Mesmer R. Molecular dynamics simulation of the limiting conductance of NaCl in supercritical water Chemical Physics Letters. 293: 289-294. DOI: 10.1016/S0009-2614(98)00766-0 |
0.368 |
|
| 1997 |
Duffy KJ, Ford RM, Cummings PT. Residence time calculation for chemotactic bacteria within porous media. Biophysical Journal. 73: 2930-6. PMID 9414207 DOI: 10.1016/S0006-3495(97)78321-8 |
0.573 |
|
| 1997 |
Borzsák I, Cummings PT. Electrofreezing of water in molecular dynamics simulation accelerated by oscillatory shear Physical Review E. 56: R6279-R6282. DOI: 10.1103/Physreve.56.R6279 |
0.364 |
|
| 1997 |
BARANYAI A, CUMMINGS PT. Directional dependence of the random kinetic energy in planar Couette flow Molecular Physics. 90: 35-41. DOI: 10.1080/002689797172831 |
0.337 |
|
| 1997 |
KOFKE DA, CUMMINGS PT. Quantitative comparison and optimization of methods for evaluating the chemical potential by molecular simulation Molecular Physics. 92: 973-996. DOI: 10.1080/002689797169600 |
0.363 |
|
| 1997 |
Gupta SA, Cochran HD, Cummings PT. Shear behavior of squalane and tetracosane under extreme confinement. III. Effect of confinement on viscosity The Journal of Chemical Physics. 107: 10335-10343. DOI: 10.1063/1.474173 |
0.367 |
|
| 1997 |
Gupta SA, Cochran HD, Cummings PT. Shear behavior of squalane and tetracosane under extreme confinement. II. Confined film structure The Journal of Chemical Physics. 107: 10327-10334. DOI: 10.1063/1.474172 |
0.339 |
|
| 1997 |
Gupta SA, Cochran HD, Cummings PT. Shear behavior of squalane and tetracosane under extreme confinement. I. Model, simulation method, and interfacial slip The Journal of Chemical Physics. 107: 10316-10326. DOI: 10.1063/1.474171 |
0.363 |
|
| 1997 |
Stevens MJ, Mondello M, Grest GS, Cui ST, Cochran HD, Cummings PT. Comparison of shear flow of hexadecane in a confined geometry and in bulk The Journal of Chemical Physics. 106: 7303-7314. DOI: 10.1063/1.473692 |
0.356 |
|
| 1997 |
Slusher JT, Cummings PT. Molecular Simulation Study of Tetraalkylammonium Halides. 1. Solvation Structure and Hydrogen Bonding in Aqueous Solutions The Journal of Physical Chemistry B. 101: 3818-3826. DOI: 10.1021/Jp963304+ |
0.338 |
|
| 1997 |
Cui S, Cummings P, Cochran H. Configurational bias Gibbs ensemble Monte Carlo simulation of vapor-liquid equilibria of linear and short-branched alkanes Fluid Phase Equilibria. 141: 45-61. DOI: 10.1016/S0378-3812(97)00209-4 |
0.394 |
|
| 1997 |
Chialvo AA, Cummings PT, Simonson JM, Mesmer RE. Molecular simulation study of speciation in supercritical aqueous NaCl solutions Journal of Molecular Liquids. 361-372. DOI: 10.1016/S0167-7322(97)00079-2 |
0.371 |
|
| 1997 |
Moore JD, Cui ST, Cummings PT, Cochran HD. Lubricant characterization by molecular simulation Aiche Journal. 43: 3260-3263. DOI: 10.1002/Aic.690431215 |
0.331 |
|
| 1996 |
Brosilow BJ, Ford RM, Sarman S, Cummings PT. Numerical Solution of Transport Equations for Bacterial Chemotaxis: Effect of Discretization of Directional Motion Siam Journal On Applied Mathematics. 56: 1639-1663. DOI: 10.1137/S0036139995282025 |
0.536 |
|
| 1996 |
Cummings PT, Chialvo AA. Molecular simulation of supercritical water and aqueous solutions Journal of Physics: Condensed Matter. 8: 9281-9287. DOI: 10.1088/0953-8984/8/47/016 |
0.396 |
|
| 1996 |
Baranyai A, Cummings PT. On the Molecular Dynamics Algorithm for Gibbs Ensemble Simulation Molecular Simulation. 17: 21-25. DOI: 10.1080/08927029608024091 |
0.353 |
|
| 1996 |
Lee SH, Cummings PT. The Rheology ofn-Butane andi-Butane by Non-Equilibrium Molecular Dynamics Simulations Molecular Simulation. 16: 229-247. DOI: 10.1080/08927029608024077 |
0.355 |
|
| 1996 |
Slusher JT, Cummings PT. Non-Iterative Constraint Dynamics Using Velocity-Explicit Verlet Methods Molecular Simulation. 18: 213-224. DOI: 10.1080/08927029608022360 |
0.352 |
|
| 1996 |
CUI ST, CUMMINGS PT, COCHRAN HD. The calculation of the viscosity from the autocorrelation function using molecular and atomic stress tensors Molecular Physics. 88: 1657-1664. DOI: 10.1080/00268979650025696 |
0.308 |
|
| 1996 |
BHUPATHIRAJU R, CUMMINGS PT, COCHRAN HD. An efficient parallel algorithm for non-equilibrium molecular dynamics simulations of very large systems in planar Couette flow Molecular Physics. 88: 1665-1670. DOI: 10.1080/00268979609484543 |
0.327 |
|
| 1996 |
Kalyuzhnyi Y, Cummings P. Phase diagram for the Lennard-Jones fluid modelled by the hard-core Yukawa fluid Molecular Physics. 87: 1459-1462. DOI: 10.1080/00268979600100981 |
0.315 |
|
| 1996 |
Kalyuzhnyi Y, Cummings P. Phase diagram for the dimerizing hard-core Yukawa fluid Molecular Physics. 87: 249-255. DOI: 10.1080/00268979600100151 |
0.324 |
|
| 1996 |
Chialvo AA, Cummings PT, Simonson JM, Mesmer RE. Temperature and density effects on the high temperature ionic speciation in dilute Na+/Cl− aqueous solutions The Journal of Chemical Physics. 105: 9248-9257. DOI: 10.1063/1.472756 |
0.341 |
|
| 1996 |
Chialvo AA, Cummings PT. Engineering a simple polarizable model for the molecular simulation of water applicable over wide ranges of state conditions The Journal of Chemical Physics. 105: 8274-8281. DOI: 10.1063/1.472718 |
0.395 |
|
| 1996 |
Baranyai A, Cummings PT. Towards the atomistic simulation of phase coexistence in nonequilibrium systems The Journal of Chemical Physics. 105: 2378-2390. DOI: 10.1063/1.472105 |
0.35 |
|
| 1996 |
Lee SH, Cummings PT. Shear viscosity of model mixtures by nonequilibrium molecular dynamics. II. Effect of dipolar interactions The Journal of Chemical Physics. 105: 2044-2055. DOI: 10.1063/1.472073 |
0.334 |
|
| 1996 |
Kalyuzhnyi YV, Cummings PT. Solution of the Chandler–Silbey–Ladanyi equation for the multicomponent hard‐sphere site–site molecular fluid: Percus–Yevick approximation The Journal of Chemical Physics. 105: 2011-2019. DOI: 10.1063/1.472069 |
0.352 |
|
| 1996 |
Cui ST, Gupta SA, Cummings PT, Cochran HD. Molecular dynamics simulations of the rheology of normal decane, hexadecane, and tetracosane The Journal of Chemical Physics. 105: 1214-1220. DOI: 10.1063/1.471971 |
0.322 |
|
| 1996 |
Baranyai A, Cummings PT. Extremum Behavior of Fluctuation Amplitudes Close to Equilibrium The Journal of Physical Chemistry. 100: 9149-9151. DOI: 10.1021/Jp953724J |
0.302 |
|
| 1996 |
Chialvo AA, Cummings PT. Microstructure of Ambient and Supercritical Water. Direct Comparison between Simulation and Neutron Scattering Experiments The Journal of Physical Chemistry. 100: 1309-1316. DOI: 10.1021/Jp951445Q |
0.36 |
|
| 1996 |
Cummings PT. Molecular dynamics simulation of realistic systems Fluid Phase Equilibria. 116: 237-248. DOI: 10.1016/0378-3812(95)02892-7 |
0.364 |
|
| 1996 |
Chialvo AA, Cummings PT, Cochran HD. Solvation structure, hydrogen bonding, and ion pairing in dilute supercritical aqueous NaCl mixtures International Journal of Thermophysics. 17: 147-156. DOI: 10.1007/Bf01448217 |
0.335 |
|
| 1996 |
Chialvo AA, Kalyuzhnyi YV, Cummings PT. Solvation thermodynamics of gas solubility at sub- and near-critical conditions Aiche Journal. 42: 571-584. DOI: 10.1002/Aic.690420226 |
0.316 |
|
| 1995 |
Duffy KJ, Cummings PT, Ford RM. Random walk calculations for bacterial migration in porous media. Biophysical Journal. 68: 800-6. PMID 7756547 DOI: 10.1016/S0006-3495(95)80256-0 |
0.573 |
|
| 1995 |
Frymier PD, Ford RM, Berg HC, Cummings PT. Three-dimensional tracking of motile bacteria near a solid planar surface. Proceedings of the National Academy of Sciences of the United States of America. 92: 6195-9. PMID 7597100 DOI: 10.1073/Pnas.92.13.6195 |
0.733 |
|
| 1995 |
Chialvo AA, Cummings PT, Cochran HD, Simonson JM, Mesmer RE. Na+–Cl−ion pair association in supercritical water The Journal of Chemical Physics. 103: 9379-9387. DOI: 10.1063/1.470707 |
0.39 |
|
| 1994 |
Lee SH, Cummings PT. Effect of three‐body forces on the shear viscosity of liquid argon The Journal of Chemical Physics. 101: 6206-6209. DOI: 10.1063/1.468402 |
0.338 |
|
| 1994 |
Chialvo AA, Cummings PT. Hydrogen bonding in supercritical water The Journal of Chemical Physics. 101: 4466-4469. DOI: 10.1063/1.467432 |
0.324 |
|
| 1994 |
Slusher JT, Decker KJ, Liu H, Vega CA, Cummings PT, O'Connell JP. Vapor-Liquid Equilibria and Salt Apparent Molar Volumes of the Water + 2-Propanol + Tetrabutylammonium Bromide System Journal of Chemical & Engineering Data. 39: 506-509. DOI: 10.1021/Je00015A024 |
0.3 |
|
| 1994 |
Cummings P, Chialvo A, Cochran H. Molecular simulation study of solvation structure in supercritical aqueous solutions Chemical Engineering Science. 49: 2735-2748. DOI: 10.1016/0009-2509(94)E0094-7 |
0.379 |
|
| 1994 |
Sarman SS, Cummings PT, Evans DJ. Nonequilibrium molecular dynamics of liquid crystals International Journal of Thermophysics. 15: 1125-1134. DOI: 10.1007/Bf01458821 |
0.31 |
|
| 1994 |
Fetsko SW, Cummings PT. Simulation of bead-and-spring chain models for semidilute polymer solutions in shear flow International Journal of Thermophysics. 15: 1085-1091. DOI: 10.1007/Bf01458817 |
0.353 |
|
| 1994 |
Chialvo AA, Cummings PT. Solute-induced effects on the structure and thermodynamics of infinitely dilute mixtures Aiche Journal. 40: 1558-1573. DOI: 10.1002/Aic.690400914 |
0.314 |
|
| 1994 |
Frymier PD, Ford RM, Cummings PT. Analysis of bacterial migration: I. Numerical solution of balance equation Aiche Journal. 40: 704-715. DOI: 10.1002/Aic.690400413 |
0.737 |
|
| 1993 |
Chialvo AA, Cummings PT. Structure of Mixed Solvent Electrolyte Solutions via Gibbs Ensemble Monte Carlo Simulation Molecular Simulation. 11: 163-175. DOI: 10.1080/08927029308022506 |
0.364 |
|
| 1993 |
Lee SH, Cummings PT. Shear viscosity of model mixtures by nonequilibrium molecular dynamics. I. Argon–krypton mixtures The Journal of Chemical Physics. 99: 3919-3925. DOI: 10.1063/1.466137 |
0.376 |
|
| 1993 |
Strauch HJ, Cummings PT. Gibbs ensemble simulation of mixed solvent electrolyte solutions Fluid Phase Equilibria. 86: 147-172. DOI: 10.1016/0378-3812(93)87173-X |
0.346 |
|
| 1993 |
Rudisill J, Cummings P. Non-equilibrium molecular dynamics approach to the rheology of model polymer fluids Fluid Phase Equilibria. 88: 99-113. DOI: 10.1016/0378-3812(93)87104-9 |
0.348 |
|
| 1993 |
Strauch HJ, Cummings PT. Computer simulation of vapor-liquid equilibrium in mixed solvent electrolyte solutions Fluid Phase Equilibria. 83: 213-222. DOI: 10.1016/0378-3812(93)87024-U |
0.358 |
|
| 1993 |
Frymier PD, Ford RM, Cummings PT. Cellular Dynamics simulations of bacterial chemotaxis Chemical Engineering Science. 48: 687-699. DOI: 10.1016/0009-2509(93)80136-E |
0.747 |
|
| 1992 |
Ford RM, Cummings PT. On the Relationship Between Cell Balance Equations for Chemotactic Cell Populations Siam Journal On Applied Mathematics. 52: 1426-1441. DOI: 10.1137/0152082 |
0.514 |
|
| 1992 |
Cummings PT, Evans DJ. Nonequilibrium molecular dynamics approaches to transport properties and non-Newtonian fluid rheology Industrial & Engineering Chemistry Research. 31: 1237-1252. DOI: 10.1021/Ie00005A001 |
0.32 |
|
| 1992 |
Cochran H, Cummings P, Karaborni S. Solvation in supercritical water Fluid Phase Equilibria. 71: 1-16. DOI: 10.1016/0378-3812(92)85001-O |
0.355 |
|
| 1992 |
Rudisill J, Cummings P. Brownian dynamics simulation of model polymer fluids in shear flow. I. Dumbbell models Journal of Non-Newtonian Fluid Mechanics. 41: 275-288. DOI: 10.1016/0377-0257(92)87002-S |
0.339 |
|
| 1991 |
Cummings PT, Cochran HD, Simonson JM, Mesmer RE, Karaborni S. Simulation of supercritical water and of supercritical aqueous solutions The Journal of Chemical Physics. 94: 5606-5621. DOI: 10.1063/1.460497 |
0.367 |
|
| 1991 |
Sarman S, Evans DJ, Cummings PT. Comment on: Nonequilibrium molecular dynamics calculation of self‐diffusion in a non‐Newtonian fluid subject to a Couette strain field The Journal of Chemical Physics. 95: 8675-8676. DOI: 10.1063/1.459886 |
0.327 |
|
| 1990 |
de Pablo JJ, Prausnitz JM, Strauch HJ, Cummings PT. Molecular simulation of water along the liquid–vapor coexistence curve from 25 °C to the critical point The Journal of Chemical Physics. 93: 7355-7359. DOI: 10.1063/1.459409 |
0.383 |
|
| 1989 |
Strauch HJ, Cummings PT. Computer Simulation of the Dielectric Properties of Liquid Water Molecular Simulation. 2: 89-104. DOI: 10.1080/08927028908032785 |
0.381 |
|
| 1989 |
Rudisill E, Cummings P. Gibbs ensemble simulation of phase equilibrium in the hard core two-Yukawa fluid model for the Lennard-Jones fluid Molecular Physics. 68: 629-635. DOI: 10.1080/00268978900102411 |
0.309 |
|
| 1989 |
Wang B, Cummings P. Non-equilibrium molecular dynamics calculation of the transport properties of carbon dioxide Fluid Phase Equilibria. 53: 191-198. DOI: 10.1016/0378-3812(89)80086-X |
0.31 |
|
| 1989 |
Wang BY, Cummings PT. Nonequilibrium molecular dynamics calculation of the shear viscosity of carbon dioxide International Journal of Thermophysics. 10: 929-940. DOI: 10.1007/Bf00503162 |
0.323 |
|
| 1988 |
Cummings PT. Shear viscosity of liquid rubidium at the triple point Journal of Physics F: Metal Physics. 18: 1439-1447. DOI: 10.1088/0305-4608/18/7/013 |
0.329 |
|
| 1988 |
Cummings PT, Varner TL. Nonequilibrium molecular dynamics calculation of the shear viscosity of liquid water The Journal of Chemical Physics. 89: 6391-6398. DOI: 10.1063/1.455407 |
0.394 |
|
| 1988 |
Perry R, Massie J, Cummings P. An analytic model for aqueous electrolyte solutions based on fluctuation solution theory Fluid Phase Equilibria. 39: 227-266. DOI: 10.1016/0378-3812(88)85007-6 |
0.318 |
|
| 1986 |
Cummings PT, Blum L. Dielectric constant of dipolar hard sphere mixtures The Journal of Chemical Physics. 85: 6658-6667. DOI: 10.1063/1.451447 |
0.349 |
|
| 1986 |
Cummings PT, Blum L. Analytic solution of the molecular Ornstein–Zernike equation for nonspherical molecules. Spheres with anisotropic surface adhesion The Journal of Chemical Physics. 84: 1833-1842. DOI: 10.1063/1.450430 |
0.344 |
|
| 1986 |
Simmsons A, Cummings P. Non-equilibrium molecular dynamics simulation of dense fluid methane Chemical Physics Letters. 129: 92-98. DOI: 10.1016/0009-2614(86)80176-2 |
0.371 |
|
| 1985 |
Lee SH, Rasaiah JC, Cummings PT. A model for association in electrolytes. Analytic solution of the hypernetted‐chain/mean spherical approximation The Journal of Chemical Physics. 83: 317-325. DOI: 10.1063/1.449772 |
0.336 |
|
| 1985 |
Cummings PT, Monson PA. Solution of the Ornstein–Zernike equation in the vicinity of the critical point of a simple fluid The Journal of Chemical Physics. 82: 4303-4311. DOI: 10.1063/1.448820 |
0.309 |
|
| 1985 |
Monson PA, Cummings PT. Solution of the Percus-Yevick equation in the coexistence region of a simple fluid International Journal of Thermophysics. 6: 573-584. DOI: 10.1007/Bf00500330 |
0.31 |
|
| 1984 |
Cummings P. Analytic studies of the hard dumbell fluid Molecular Physics. 53: 849-863. DOI: 10.1080/00268978400102691 |
0.309 |
|
| 1983 |
Cummings P, Ram J, Gray C, Wertheim M. Evaluation of the CPY and PYX approximations for short ranged anisotropic potentials Molecular Physics. 50: 1133-1140. DOI: 10.1080/00268978300102911 |
0.318 |
|
| 1983 |
Cummings P, Ram J, Barker R, Gray C, Wertheim M. Evaluation of the SSC/LHNC, SSCF and PY approximations for short ranged, anisotropic potentials Molecular Physics. 48: 1177-1207. DOI: 10.1080/00268978300100851 |
0.348 |
|
| 1982 |
Cummings PT, Egelstaff PA. Influence of the Friedel oscillations on the structure on liquid rubidium Journal of Physics F: Metal Physics. 12: 233-244. DOI: 10.1088/0305-4608/12/2/003 |
0.326 |
|
| 1982 |
Ram J, Barker R, Cummings PT, Egelstaff PA. A Test of Computer Simulation of Low Density Gases Physics and Chemistry of Liquids. 11: 315-325. DOI: 10.1080/00319108208080753 |
0.303 |
|
| 1982 |
Morriss G, Cummings P. The dielectric constant of polar hard dumb-bells Molecular Physics. 45: 1099-1112. DOI: 10.1080/00268978200100841 |
0.323 |
|
| 1981 |
Cummings P, Nezbeda I, Smith WR, Morriss G. Monte Carlo simulation results for the full pair correlation function of the hard dumbell fluid Molecular Physics. 43: 1471-1475. DOI: 10.1080/00268978100102241 |
0.565 |
|
| 1981 |
Cummings P, Stell G. Mean spherical approximation for a model liquid metal potential Molecular Physics. 43: 1267-1291. DOI: 10.1080/00268978100102051 |
0.309 |
|
| 1981 |
Cummings PT, Wright CC. Solution of the Ornstein-Zernike equation for a soft-core Yukawa fluid. III. A restricted model for electrolytes and fused salts Journal of Statistical Physics. 24: 405-412. DOI: 10.1007/Bf01012812 |
0.322 |
|
| Show low-probability matches. |
