Publications
191 results found
Nicholson D, Cracknell R, Quirke N, 1996, A transition in the diffusivity of adsorbed fluids through micropores, Langmuir, Vol: 12, Pages: 4050-4052, ISSN: 0743-7463
, 1996, Simulation studies of pore blocking hysteresis in model porous carbon networks, fundamentals of adsorption, Boston, Proceedings of the Fifth International Conference on fundamentals of adsorption, Publisher: Kluwer Academic Publishers, Pages: 571-578
Fuchs A, Quirke N, 1996, Adsorption, phase transitions and transport in porous materials, MOLECULAR SIMULATION, Vol: 17, Pages: 197-197, ISSN: 0892-7022
quirke N, 1996, Some Recent Developments in Computational Chemistry, Molecular Simulation, Vol: 16
maddox MW, lastoskie CM, gubbins KE, et al., 1996, Fundamentals of adsorption, Fundamentals of adsorption, Editors: LeVan, Publisher: Kluwer Academic Pub, ISBN: 9780792397137
Fundamentals of Adsorption is the proceedings of the fifth International Conference on the Fundamentals of Adsorption, which was held on May 13-18, 1995 at the Asilomar Conference Center, Pacific Grove, California.
Callaway MJ, Tildesley DJ, Quirke N, 1996, Molecular dynamics simulation of a Langmuir-Blodgett patch, MOLECULAR SIMULATION, Vol: 18, Pages: 277-&, ISSN: 0892-7022
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- Citations: 5
Nicholson D, Cracknell R, Quirke N, 1996, A transition in the diffusivity of adsorbed fluids through micropores, Langmuir, Vol: 12, Pages: 4050-4052, ISSN: 0743-7463
Lastoskie CM, Quirke N, Gubbins KE, 1996, Structure of porous adsorbents: Analysis using density functional theory and molecular simulation, Equilibria and dynamics of gas adsorption on heterogeneous solid surfaces, Editors: Rudzinski, Steele, Zgrablich, Lastoskie, Gubbins, Quirke, Amsterdam, Publisher: Elsevier, Pages: 745-775
Callaway MJ, Tildesley DJ, Quirke N, 1996, Molecular dynamics simulation of a Langmuir-Blodgett patch, Molecular Simulation, Vol: 18, ISSN: 0892-7022
Quirke N, 1996, The prediction of fluid phase equilibria using molecular methods, Chemical Engineering and Procesing, ISSN: 0255-2701
Tennison SR, Quirke N, 1996, The interpretation of pore size distributions of microporous carbons, Carbon, Vol: 34, ISSN: 0008-6223
Newsam J, Quirke N, 1996, Role of density fluctuations in the solvation structure in supercritical dilute solutions: a molecular dynamics study, Fluid Phase Equilibria, Vol: 125, ISSN: 0378-3812
Gubbins KE, Quirke N, 1996, Molecular simulation and industrial applications: Methods, examples and prospects, Molecular Simulation, ISSN: 0892-7022
CRACKNELL RF, NICHOLSON D, QUIRKE N, 1995, DIRECT MOLECULAR-DYNAMICS SIMULATION OF FLOW DOWN A CHEMICAL-POTENTIAL GRADIENT IN A SLIT-SHAPED MICROPORE, PHYSICAL REVIEW LETTERS, Vol: 74, Pages: 2463-2466, ISSN: 0031-9007
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- Citations: 197
CALLAWAY M, TILDESLEY DJ, QUIRKE N, 1994, REORDERING OF SURFACE PHASES DURING ATOMIC-FORCE MICROSCOPY - A SIMULATION STUDY, LANGMUIR, Vol: 10, Pages: 3350-3356, ISSN: 0743-7463
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- Citations: 15
lastoskie C, gubbins KE, quirke N, 1994, Characterization of Porous Solids III, Characterization of Porous Solids III, Editors: Rouquérol, Publisher: Elsevier Science Limited, Pages: 51-60, ISBN: 9780444814913
The edited papers included in the present volume have been selected from the 155 oral and poster presentations given at this symposium, which attracted 200 participants from 28 different countries. The following topics were discussed:1.
LASTOSKIE C, GUBBINS KE, QUIRKE N, 1994, PORE-SIZE DISTRIBUTION ANALYSIS AND NETWORKING - STUDIES OF MICROPOROUS SORBENTS, IUPAC Symposium on Characterization of Porous Solids (COPS III), Publisher: ELSEVIER SCIENCE PUBL B V, Pages: 51-60
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- Citations: 17
CRACKNELL RF, NICHOLSON D, QUIRKE N, 1994, A GRAND-CANONICAL MONTE-CARLO STUDY OF LENNARD-JONES MIXTURES IN SLIT PORES .2. MIXTURES OF 2 CENTER ETHANE WITH METHANE, MOLECULAR SIMULATION, Vol: 13, Pages: 161-175, ISSN: 0892-7022
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- Citations: 58
KIM KS, TILDESLEY DJ, QUIRKE N, 1994, MOLECULAR-DYNAMICS OF LANGMUIR-BLODGETT-FILMS .2. BILAYERS, MOLECULAR SIMULATION, Vol: 13, Pages: 101-114, ISSN: 0892-7022
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- Citations: 6
KIM KS, MOLLER MA, TILDESLEY DJ, et al., 1994, MOLECULAR-DYNAMICS SIMULATIONS OF LANGMUIR-BLODGETT MONOLAYERS WITH EXPLICIT HEADGROUP INTERACTIONS, MOLECULAR SIMULATION, Vol: 13, Pages: 77-99, ISSN: 0892-7022
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- Citations: 12
CRACKNELL RF, NICHOLSON D, QUIRKE N, 1993, A GRAND-CANONICAL MONTE-CARLO STUDY OF LENNARD-JONES MIXTURES IN SLIT SHAPED PORES, MOLECULAR PHYSICS, Vol: 80, Pages: 885-897, ISSN: 0026-8976
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- Citations: 130
CLINT JH, QUIRKE N, 1993, CONTACT ANGLES ON PARTICLES FROM LANGMUIR TROUGH STUDIES, COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, Vol: 78, Pages: 277-278, ISSN: 0927-7757
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- Citations: 41
lastoskie C, gubbins KE, quirke N, 1993, Pore Size Heterogeneity and the Carbon Slit Model: A Density Functional Theory Model, Langmuir: the ACS journal of surfaces and colloids, Vol: 9
lastoskie C, gubbins KE, quirke N, 1993, Pore Size Distribution Analysis of Microporous Carbons: A Density Functional Approach, The Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces and Biophysical, Vol: 97
aukett PN, riddiford S, tennison SR, et al., 1992, Methane Adsorption on Microporous Carbons: A Comparison of Experiment, Theory and Simulation, Vol: 30
moller MA, tildesley DJ, kim KS, et al., 1991, Molecular Dynamics Simulation of a Langmuir-Blodgett Film, j chem phys, Vol: 94
goodbody SJ, watanabe D, macgowan D, et al., 1991, Molecular modelling of Methane and Butane in Silicalite, J. Chem. Soc. Faraday Trans, Vol: 87
quirke N, 1990, Correlations and connectivity, Correlations and connectivity, Editors: Stanley, Ostrowsky, Division, Publisher: Kluwer Academic Pub
CORRELATIONS & CONNECTIVITY GEOMETRIC ASPECTS OF PHYSICS, CHEMISTRY & BIOLOGY • PREFACE • Every child knows that "If A connects to B and B connects to C, then a change in A leads to a change in C." This simple fact is exemplified by an ...
stapleton MR, tildesley DJ, quirke N, 1990, Phase Equilibria In Polydisperse Fluids, The Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces and Biophysical, Vol: 92
halpin TPJ, quirke N, 1990, A New Method of Continuous Thermodynamics Applied in an Equation of State, SPE Reservoir Evaluation and Engineering, Vol: 5
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