Year |
Citation |
Score |
2020 |
Campos-Villalobos G, Siperstein FR, Charles A, Patti A. Solvent-induced morphological transitions in methacrylate-based block-copolymer aggregates. Journal of Colloid and Interface Science. 572: 133-140. PMID 32240786 DOI: 10.1016/J.Jcis.2020.03.067 |
0.588 |
|
2020 |
Xiang H, Shao Y, Ameen A, Chen H, Yang W, Gorgojo P, Siperstein FR, Fan X, Pan Q. Adsorptive separation of C2H6/C2H4 on metal-organic frameworks (MOFs) with pillared-layer structures Separation and Purification Technology. 242: 116819. DOI: 10.1016/J.Seppur.2020.116819 |
0.305 |
|
2020 |
Xiang H, Fan X, Siperstein FR. Understanding ethane/ethylene adsorption selectivity in ethane-selective microporous materials Separation and Purification Technology. 241: 116635. DOI: 10.1016/J.Seppur.2020.116635 |
0.4 |
|
2020 |
Xiang H, Ameen A, Shang J, Jiao Y, Gorgojo P, Siperstein FR, Fan X. Synthesis and modification of moisture-stable coordination pillared-layer metal-organic framework (CPL-MOF) CPL-2 for ethylene/ethane separation Microporous and Mesoporous Materials. 293: 109784. DOI: 10.1016/J.Micromeso.2019.109784 |
0.351 |
|
2020 |
Xiang H, Ameen A, Gorgojo P, Siperstein FR, Holmes SM, Fan X. Selective adsorption of ethane over ethylene on M(bdc)(ted)0.5 (M = Co, Cu, Ni, Zn) metal-organic frameworks (MOFs) Microporous and Mesoporous Materials. 292: 109724. DOI: 10.1016/J.Micromeso.2019.109724 |
0.341 |
|
2020 |
Xiang H, Carter JH, Tang CC, Murray CA, Yang S, Fan X, Siperstein FR. C2H4 and C2H6 adsorption-induced structural variation of pillared-layer CPL-2 MOF: A combined experimental and Monte Carlo simulation study Chemical Engineering Science. 218: 115566. DOI: 10.1016/J.Ces.2020.115566 |
0.422 |
|
2020 |
Campos-Villalobos G, Siperstein FR, D’Agostino C, Forster L, Patti A. Self-diffusion of glycerol in γ-alumina nanopores. The neglected role of pore saturation in the dynamics of confined polyalcohols Applied Surface Science. 516: 146089. DOI: 10.1016/J.Apsusc.2020.146089 |
0.551 |
|
2019 |
Chia CL, Alloway RM, Jephson I, Clarke SM, Filip SV, Siperstein FR, Avendano C. Competitive Adsorption of a Multi-functional Amine and Phenol Surfactant with Ethanol on Hematite from Non-aqueous Solution. The Journal of Physical Chemistry. B. PMID 30667225 DOI: 10.1021/Acs.Jpcb.8B09704 |
0.35 |
|
2019 |
Evans AD, Cummings MS, Luebke R, Brown MS, Favero S, Attfield MP, Siperstein F, Fairen-Jimenez D, Hellgardt K, Purves R, Law D, Petit C. Screening Metal–Organic Frameworks for Dynamic CO/N2 Separation Using Complementary Adsorption Measurement Techniques Industrial & Engineering Chemistry Research. 58: 18336-18344. DOI: 10.1021/Acs.Iecr.9B03724 |
0.341 |
|
2019 |
Zeleňák V, Skřínska M, Siperstein FR, Patti A. Phase evolution during one-pot synthesis of amine modified mesoporous silica materials: Preparation, properties, carbon dioxide adsorption Applied Surface Science. 476: 886-896. DOI: 10.1016/J.Apsusc.2019.01.146 |
0.636 |
|
2018 |
Hardy A, Dix J, Williams CD, Siperstein FR, Carbone P, Bock H. Design Rules for Graphene and Carbon-Nanotube Solvents and Dispersants. Acs Nano. PMID 29361221 DOI: 10.1021/Acsnano.7B05159 |
0.321 |
|
2018 |
Xiang H, Fan X, Siperstein FR. Design of 2D materials for selective adsorption: a comparison between Monte Carlo simulations and direct numerical integration Molecular Systems Design & Engineering. 3: 636-644. DOI: 10.1039/C8ME00024G |
0.328 |
|
2018 |
Al-Jadir TM, Siperstein FR. The influence of the pore size in Metal−Organic Frameworks in adsorption and separation of hydrogen sulphide: A molecular simulation study Microporous and Mesoporous Materials. 271: 160-168. DOI: 10.1016/J.Micromeso.2018.06.002 |
0.471 |
|
2018 |
Al-Janabi N, Martis V, Servi N, Siperstein FR, Fan X. Cyclic adsorption of water vapour on CuBTC MOF: Sustaining the hydrothermal stability under non-equilibrium conditions Chemical Engineering Journal. 333: 594-602. DOI: 10.1016/J.Cej.2017.09.197 |
0.346 |
|
2018 |
Al-Janabi N, Vakili R, Kalumpasut P, Gorgojo P, Siperstein FR, Fan X, McCloskey P. Velocity variation effect in fixed bed columns: A case study of CO2
capture using porous solid adsorbents Aiche Journal. 64: 2189-2197. DOI: 10.1002/Aic.16135 |
0.4 |
|
2017 |
Chia CL, Avendano C, Siperstein FR, Filip SV. Adsorption of Organic Compounds on Hematite (α-Fe2O3) using ReaxFF. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 28862872 DOI: 10.1021/Acs.Langmuir.7B02374 |
0.372 |
|
2017 |
Rezlerova E, Zukal A, Cejka J, Siperstein FR, Brennan JK, Lisal M. Adsorption and Diffusion of C1 to C4 Alkanes in Dual-Porosity Zeolites by Molecular Simulations. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 28689411 DOI: 10.1021/Acs.Langmuir.7B01772 |
0.422 |
|
2016 |
Rodgers TL, Magee JE, Amure T, Siperstein FR. Micelle response to changes in solvent properties. Soft Matter. PMID 27782285 DOI: 10.1039/C6Sm01761D |
0.32 |
|
2016 |
Al-Janabi N, Fan X, Siperstein FR. Assessment of MOF's Quality: Quantifying Defect Content in Crystalline Porous Materials. The Journal of Physical Chemistry Letters. 1490-1494. PMID 27050536 DOI: 10.1021/Acs.Jpclett.6B00297 |
0.462 |
|
2016 |
Gonciaruk A, Runcieman L, Avendaño C, Siperstein FR. 8th Industrial Fluid Properties Simulation Challenge: n-Perfluorohexane adsorption prediction on activated carbon BAM-P109 by molecular simulation Adsorption Science & Technology. 34: 93-109. DOI: 10.1177/0263617415619537 |
0.406 |
|
2016 |
Al-Jadir TM, Siperstein FR. Monte Carlo Simulation of Adsorption of Polar and Nonpolar Gases in (FP)YEu Metal–Organic Framework Journal of Chemical & Engineering Data. 61: 4209-4214. DOI: 10.1021/Acs.Jced.6B00578 |
0.435 |
|
2016 |
Al-Janabi N, Deng H, Borges J, Liu X, Garforth A, Siperstein FR, Fan X. A Facile Post-Synthetic Modification Method to Improve Hydrothermal Stability and CO2 Selectivity of CuBTC Metal-Organic Framework Industrial and Engineering Chemistry Research. 55: 7941-7949. DOI: 10.1021/Acs.Iecr.5B04217 |
0.404 |
|
2015 |
Gonciaruk A, Althumayri K, Harrison WJ, Budd PM, Siperstein FR. PIM-1/graphene composite: A combined experimental and molecular simulation study Microporous and Mesoporous Materials. 209: 126-134. DOI: 10.1016/J.Micromeso.2014.07.007 |
0.404 |
|
2015 |
Al-Janabi N, Hill P, Torrente-Murciano L, Garforth A, Gorgojo P, Siperstein F, Fan X. Mapping the Cu-BTC metal-organic framework (HKUST-1) stability envelope in the presence of water vapour for CO2 adsorption from flue gases Chemical Engineering Journal. 281: 669-677. DOI: 10.1016/J.Cej.2015.07.020 |
0.422 |
|
2015 |
Gonciaruk A, Siperstein FR. In silico designed microporous carbons Carbon. 88: 185-195. DOI: 10.1016/J.Carbon.2015.02.073 |
0.439 |
|
2014 |
Figueroa-Gerstenmaier S, Siperstein FR, Celzard A, Fierro V. Application of density functional theory for determining pore-size distributions of microporous activated carbons Adsorption Science and Technology. 32: 23-36. DOI: 10.1260/0263-6174.32.1.23 |
0.336 |
|
2014 |
Regno AD, Siperstein FR. Comparison of generic force fields for packing of concave molecules Molecular Physics. 112: 2241-2248. DOI: 10.1080/00268976.2014.886735 |
0.356 |
|
2013 |
Abbott LJ, McDermott AG, Del Regno A, Taylor RG, Bezzu CG, Msayib KJ, McKeown NB, Siperstein FR, Runt J, Colina CM. Characterizing the structure of organic molecules of intrinsic microporosity by molecular simulations and X-ray scattering. The Journal of Physical Chemistry. B. 117: 355-64. PMID 23265381 DOI: 10.1021/Jp308798U |
0.386 |
|
2013 |
Leay L, Siperstein FR. Single polymer chain surface area as a descriptor for rapid screening of microporous polymers for gas adsorption Adsorption Science and Technology. 31: 99-112. DOI: 10.1260/0263-6174.31.1.99 |
0.304 |
|
2013 |
Del Regno A, Gonciaruk A, Leay L, Carta M, Croad M, Malpass-Evans R, McKeown NB, Siperstein FR. Polymers of intrinsic microporosity containing tröger base for CO 2 capture Industrial and Engineering Chemistry Research. 52: 16939-16950. DOI: 10.1021/Ie402846A |
0.39 |
|
2013 |
Del Regno A, Siperstein FR. Organic molecules of intrinsic microporosity: Characterization of novel microporous materials Microporous and Mesoporous Materials. 176: 55-63. DOI: 10.1016/J.Micromeso.2013.03.041 |
0.472 |
|
2012 |
Amrouche H, Creton B, Siperstein F, Nieto-Draghi C. Prediction of thermodynamic properties of adsorbed gases in zeolitic imidazolate frameworks Rsc Advances. 2: 6028-6035. DOI: 10.1039/C2Ra00025C |
0.454 |
|
2011 |
Rodgers TL, Mihailova O, Siperstein FR. Dissolution of lamellar phases. The Journal of Physical Chemistry. B. 115: 10218-27. PMID 21786764 DOI: 10.1021/Jp111464B |
0.363 |
|
2011 |
DUTTON H, SIPERSTEIN F, TIDDY G. PRODUCT FORMULATION WITH SURFACTANT NANOSTRUCTURES: LIQUID CRYSTALS, SOFT SOAP AND A PIECE OF CAKE Cosmos. 7: 65-74. DOI: 10.1142/S0219607711000687 |
0.318 |
|
2011 |
Amrouche H, Aguado S, Pérez-Pellitero J, Chizallet C, Siperstein F, Farrusseng D, Bats N, Nieto-Draghi C. Experimental and computational study of functionality impact on sodalite-zeolitic imidazolate frameworks for CO2 separation Journal of Physical Chemistry C. 115: 16425-16432. DOI: 10.1021/Jp202804G |
0.373 |
|
2011 |
Larsen GS, Lin P, Siperstein FR, Colina CM. Methane adsorption in PIM-1 Adsorption. 17: 21-26. DOI: 10.1007/S10450-010-9281-7 |
0.433 |
|
2010 |
Pérez-Pellitero J, Amrouche H, Siperstein FR, Pirngruber G, Nieto-Draghi C, Chaplais G, Simon-Masseron A, Bazer-Bachi D, Peralta D, Bats N. Adsorption of CO(2), CH(4), and N(2) on zeolitic imidazolate frameworks: experiments and simulations. Chemistry (Weinheim An Der Bergstrasse, Germany). 16: 1560-71. PMID 19998434 DOI: 10.1002/Chem.200902144 |
0.458 |
|
2010 |
Siperstein FR, Lísal M, Brennan JK. A molecular simulation study of adsorption of nitrogen and methane in titanium silicate (ETS-4) Collection of Czechoslovak Chemical Communications. 75: 145-164. DOI: 10.1135/Cccc2009102 |
0.412 |
|
2009 |
Patti A, MacKie AD, Siperstein FR. Monte Carlo simulations of self-assembling hexagonal and cage-like bifunctional periodic mesoporous materials Journal of Materials Chemistry. 19: 7848-7855. DOI: 10.1039/B914537K |
0.631 |
|
2009 |
Patti A, MacKie AD, Zelenak V, Siperstein FR. One-pot synthesis of amino functionalized mesoporous silica materials: Using simulations to understand transitions between different structures Journal of Materials Chemistry. 19: 724-732. DOI: 10.1039/B813016G |
0.6 |
|
2009 |
Magee JE, Siperstein FR. Formation of ordered mesoporous materials under slow aggregation conditions Journal of Physical Chemistry C. 113: 1680-1685. DOI: 10.1021/Jp8071553 |
0.324 |
|
2008 |
Patti A, Mackie AD, Siperstein FR. One-pot synthesis of functional mesoporous materials Aiche Annual Meeting, Conference Proceedings. |
0.481 |
|
2007 |
Patti A, Mackie AD, Siperstein FR. Monte carlo simulation of self-assembled ordered hybrid materials. Langmuir : the Acs Journal of Surfaces and Colloids. 23: 6771-80. PMID 17489610 DOI: 10.1021/La063296G |
0.627 |
|
2007 |
Patti A, Mackie AD, Siperstein FR. Monte Carlo simulation of self-assembled ordered hybrid materials Langmuir. 23: 6771-6780. DOI: 10.1021/la063296g |
0.531 |
|
2007 |
Patti A, Siperstein FR, Mackie AD. Phase behavior of model surfactants in the presence of hybrid particles Journal of Physical Chemistry C. 111: 16035-16044. DOI: 10.1021/Jp074486I |
0.58 |
|
2007 |
Prosenjak C, Patti A, Siperstein FR, Seaton NA. Modelling the synthesis of periodic mesoporous silicas Studies in Surface Science and Catalysis. 170: 1652-1659. DOI: 10.1016/S0167-2991(07)81043-3 |
0.608 |
|
2006 |
Coasne B, Hung FR, Pellenq RJ, Siperstein FR, Gubbins KE. Adsorption of simple gases in MCM-41 materials: the role of surface roughness. Langmuir : the Acs Journal of Surfaces and Colloids. 22: 194-202. PMID 16378420 DOI: 10.1021/La051676G |
0.422 |
|
2006 |
Fierro V, Bosch G, Siperstein FR. Pore size distribution in microporous carbons obtained from molecular modeling and density functional theory Studies in Surface Science and Catalysis. 160: 519-526. DOI: 10.1016/S0167-2991(07)80067-X |
0.392 |
|
2006 |
Patti A, Mackie AD, Siperstein FR. Molecular simulation study on the structure of templated porous materials obtained from different inorganic precursors Studies in Surface Science and Catalysis. 160: 495-502. DOI: 10.1016/S0167-2991(07)80064-4 |
0.625 |
|
2006 |
Hung FR, Coasne B, Gubbins KE, Siperstein FR, Thommes M, Sliwinska-Bartkowiak M. A Monte Carlo study of capillary condensation of krypton within realistic models of templated mesoporous silica materials Studies in Surface Science and Catalysis. 160: 153-160. DOI: 10.1016/S0167-2991(07)80021-8 |
0.484 |
|
2005 |
Hung FR, Coasne B, Santiso EE, Gubbins KE, Siperstein FR, Sliwinska-Bartkowiak M. Molecular modeling of freezing of simple fluids confined within carbon nanotubes. The Journal of Chemical Physics. 122: 144706. PMID 15847552 DOI: 10.1063/1.1881072 |
0.452 |
|
2005 |
Chennamsetty N, Bock H, Scanu LF, Siperstein FR, Gubbins KE. Cosurfactant and cosolvent effects on surfactant self-assembly in supercritical carbon dioxide. The Journal of Chemical Physics. 122: 094710. PMID 15836165 DOI: 10.1063/1.1855291 |
0.308 |
|
2005 |
Coasne B, Hung FR, Siperstein FR, Gubbins KE. Molecular simulation of gas adsorption in realistic models of silica nanopores Annales De Chimie: Science Des Materiaux. 30: 375-383. DOI: 10.3166/Acsm.30.375-383 |
0.332 |
|
2005 |
Siperstein FR, Mackie AD. Phase behavior of a model surfactant-solvent system at intermediate and high densities Colloids and Surfaces a: Physicochemical and Engineering Aspects. 270: 277-284. DOI: 10.1016/J.Colsurfa.2005.06.015 |
0.42 |
|
2005 |
Sliwinska-Bartkowiak M, Hung FR, Santiso EE, Coasne B, Dudziak G, Siperstein FR, Gubbins KE. Effect of confinement on freezing of CCl4 in cylindrical pores Adsorption. 11: 391-396. DOI: 10.1007/S10450-005-5956-X |
0.406 |
|
2005 |
Siperstein FR. Determination of azeotropic behavior in adsorbed mixtures Adsorption. 11: 55-59. DOI: 10.1007/S10450-005-5898-3 |
0.381 |
|
2005 |
Patti A, Mackie AD, Siperstein FR. Self-assembly of ordered organic-inorganic materials Aiche Annual Meeting, Conference Proceedings. 10766. |
0.49 |
|
2004 |
Lisal M, Brennan JK, Smith WR, Siperstein FR. Dual control cell reaction ensemble molecular dynamics: a method for simulations of reactions and adsorption in porous materials. The Journal of Chemical Physics. 121: 4901-12. PMID 15332926 DOI: 10.1063/1.1782031 |
0.378 |
|
2003 |
Colina CM, Olivera-Fuentes CG, Siperstein FR, Lísal M, Gubbins KE. Thermal properties of supercritical carbon dioxide by Monte Carlo simulations Molecular Simulation. 29: 405-412. DOI: 10.1080/0892702031000117135 |
0.378 |
|
2002 |
Siperstein F, Myers AL, Talu O. Long range corrections for computer simulations of adsorption Molecular Physics. 100: 2025-2030. DOI: 10.1080/00268970110109916 |
0.366 |
|
2002 |
Colina CM, Lísal M, Siperstein FR, Gubbins KE. Accurate CO2 Joule-Thomson inversion curve by molecular simulations Fluid Phase Equilibria. 202: 253-262. DOI: 10.1016/S0378-3812(02)00126-7 |
0.352 |
|
2002 |
Siperstein FR, Gubbins KE. Influence of synthesis conditions on surface heterogeneity of M41 type materials studied with lattice Monte Carlo Studies in Surface Science and Catalysis. 144: 647-654. DOI: 10.1016/S0167-2991(02)80192-6 |
0.521 |
|
2001 |
Siperstein FR, Gubbins KE. Synthesis and characterization of templated mesoporous materials using molecular simulation Molecular Simulation. 27: 339-352. DOI: 10.1080/08927020108031357 |
0.514 |
|
2001 |
Myers AL, Siperstein F. Characterization of adsorbents by energy profile of adsorbed molecules Colloids and Surfaces a: Physicochemical and Engineering Aspects. 187: 73-81. DOI: 10.1016/S0927-7757(01)00624-0 |
0.38 |
|
2001 |
Siperstein FR, Myers AL. Mixed-gas adsorption Aiche Journal. 47: 1141-1159. DOI: 10.1002/Aic.690470520 |
0.393 |
|
2000 |
Shen D, Bülow M, Siperstein F, Engelhard M, Myers AL. Comparison of experimental techniques for measuring isosteric heat of adsorption Adsorption. 6: 275-286. DOI: 10.1023/A:1026551213604 |
0.362 |
|
1999 |
Siperstein F, Gorte RJ, Myers AL. Measurement of excess functions of binary gas mixtures adsorbed in zeolites by adsorption calorimetry Adsorption. 5: 169-176. DOI: 10.1023/A:1008973409819 |
0.403 |
|
1999 |
Siperstein F, Gorte RJ, Myers AL. A New Calorimeter for Simultaneous Measurements of Loading and Heats of Adsorption from Gaseous Mixtures Langmuir. 15: 1570-1576. DOI: 10.1021/La980946A |
0.302 |
|
1999 |
Savitz S, Siperstein FR, Huber R, Tieri SM, Gorte RJ, Myers AL, Grey CP, Corbin DR. Adsorption of Hydrofluorocarbons HFC-134 and HFC-134A on X and Y Zeolites: Effect of Ion-Exchange on Selectivity and Heat of Adsorption The Journal of Physical Chemistry B. 103: 8283-8289. DOI: 10.1021/Jp990560O |
0.352 |
|
1998 |
Savitz S, Siperstein F, Gorte RJ, Myers AL. Calorimetric study of adsorption of alkanes in high-silica zeolites Journal of Physical Chemistry B. 102: 6865-6872. DOI: 10.1021/Jp981836F |
0.373 |
|
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