Nick Quirke Ph.D.
| Position |
Department / Business Unit |
| Professor & Chair in Physical Chemistry |
Computational, Theoretical and Structural Chemistry |
| Institution |
Disciplines |
| Imperial College London |
Chemistry Nanofluidics Modeling |
| City |
State / Provence |
| London, Dublin |
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| Country |
Website |
| UK |
link
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| Fax |
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Nick Quirke is Professor of Physical Chemistry and Head of the Computational, Theoretical and Structural Chemistry Section at Imperial College, University of London. He is also Director, Masters Programme in Nanomaterials and Director, Postgraduate Training. Quirke received the 2006 Nano Science and Technology Institute (NSTI) Fellow Award for his outstanding contributions to advancing the International Nanotechnology, Microtechnology and Biotechnology Community.
Prof. Quirke's research group conducts fundamental research in key areas of computational nanoscience, with an in-depth interest in simulating nanoflows. The way fluids flow into and fill regular nanopores is of wide interest; however there is little experimental data and few validated theoretical models. Nanoscale flow is dominated by surface properties and these can be studied directly using molecular simulation of model systems.
In recent work, Quirke and his team have considered equilibrium, steady state and transient flow in nanopores (1-5). and carried out molecular dynamics simulations of carbon nanotubes imbibing oil at an oil/vapour interface at 300K (1,2). Prof. Quirke's team also found the smallest (7,7) nanotubes imbibe extremely rapidly (less than or equal to 800 m/s with the penetration length L a linear function of time. The team also derived expressions for the penetration length L and the velocity of the imbibing oil and related both to the solid-fluid surface tensions and interfacial friction via the Maxwell coefficient.
Career Highlights
Prior to joining Imperial College, Quirke was Professor of Physical Chemistry and Director, Centre for Computational Chemistry at the University of Wales in Bangor. Prior to that, he was Deputy Director of the European Center for Computational Science and Technology. Early in his career, Quirke worked for British Petroleum, where he was a Principal Research Associate for corporate molecular modeling, where he directed BP's research into applications of modeling for the exploration, chemical and oil busines.
Awards
He is a Visiting Fellow at the National Physical Laboratory (UK). He received the 1998 Royal Society of Chemistry Medal for Thermodynamics and Statistical Mechanics and was Royal Society/Kan Tong Po Professor at the University of Hong Kong for the session 2003/2004. He was awarded the 2006 NSTI Fellow Award for Outstanding Contributions towards the Advancement of the International Nanotechnology, Microtechnology and Biotechnology Community.
Important Articles
| Longhurst MJ, Quirke N, The radial breathing mode of carbon nanotubes, Molecular Simulation, 2005, Vol: 31, Pages: 135 - 141, ISSN: 0892-7022
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| Supple S, Quirke N, Molecular dynamics of transient oil flows in nanopores. II. Density profiles and molecular structure for decane in carbon nanotubes (Article no. 104706), Journal of Chemical Physics, 2005, Vol: 122, ISSN: 0021-9606
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| Sweatman MB, Quirke N, Gas adsorption in active carbons and the slit-pore model 1: pure gas adsorption, Journal of Physical Chemistry B, 2005, Vol: 109, Pages: 10381 - 10388, ISSN: 1520-6106
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| Sweatman MB, Quirke N, Gas adsorption in active carbons and the slit-pore model 2: mixture adsorption prediction with DFT and IAST, Journal of Physical Chemistry B, 2005, Vol: 109, Pages: 10389 - 10394, ISSN: 1520-6106 |
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