M P Allen Publications
2023
- [a — mauleonamieva.a:2023.a]
- Abraham Mauleon-Amieva, Michael P. Allen, Tanniemola B. Liverpool, C. Patrick Royall. Dynamics and interactions of Quincke roller clusters: From orbits and flips to excited states. Science Advances, 9, eadf5144, 2023. (doi:10.1126/sciadv.adf5144Link opens in a new window open access).
2022
- [a — allen.mp:2022.a]
- Michael P. Allen. Book Review: Liquid Crystals and Their Computer Simulations by Claudio Zannoni. Liquid Crystals Today, 31, 28–30, 2022. (doi:10.1080/1358314X.2022.2137991Link opens in a new window open access).
2020
- [a — box.sj:2020.a]
- Stuart J. Box, Michael P. Allen, David B. Phillips, Stephen H. Simpson. Entropy production in an elementary, light driven micro-machine. Frontiers in Physics, 8, 538, 2020. (doi:10.3389/fphy.2020.593122Link opens in a new window open access).
2019
- [a — allen.mp:2019.a]
- Michael P. Allen. Molecular simulation of liquid crystals. Mol. Phys., 117, 2391–2417, 2019. (doi:10.1080/00268976.2019.1612957Link opens in a new window).
2017
- [a — ambler.m:2017.a]
- Michael Ambler, Bart Vorselaars, Michael P. Allen and David Quigley. Solid-liquid interfacial free energy of ice 1h, ice 1c and ice 0 within a mono-atomic model of water via the capillary wave method. J. Chem. Phys., 146, 074701, 2017. (doi:10.1063/1.4975776Link opens in a new window).
- [b — humpert.a:2017.a]
- Anja Humpert, Samuel F. Brown and Michael P. Allen. Molecular simulations of entangled defect structures around nanoparticles in nematic liquid crystals. Liquid Crystals, 45, 59–69, 2018. (doi:10.1080/02678292.2017.1295478Link opens in a new window open access).
- [c — allen.mp:2017.a]
- Michael P. Allen and Dominic J. Tildesley. Computer Simulation of Liquids, Second Edition, 640pp (Oxford University Press, June 2017). (Paperback, ISBN 9780198803201 Link opens in a new window, hardback, ISBN 9780198803195Link opens in a new window).
- [d — rutter.go:2017.a]
- Gil O. Rutter, Aaron H. Brown, David Quigley, Tiffany R. Walsh and Michael P. Allen. Emergence of order in self-assembly of the intrinsically disordered biomineralisation peptide n16N. Mol. Simul., 44, 463–469, 2018. (doi:10.1080/08927022.2017.1405158Link opens in a new window open access).
2016
- [a — allen.mp:2016.a]
- Michael P. Allen. Density functional theory for chiral nematic liquid crystals. Mol. Phys., 114, 2574–2579, 2016. (doi:10.1080/00268976.2016.1168532Link opens in a new window).
- [b — humpert.a:2016.a]
- Anja Humpert, Andrew J. Masters and Michael P. Allen. Orientational dynamics in nematic liquid crystals. A coarse-grained simulation study. Euro. Phys. J. Spec. Topics, 225, 1723–1732, 2016. (doi:10.1140/epjst/e2016-60118-1Link opens in a new window and open accessLink opens in a new window).
2015
- [a — humpert.a:2015.a]
- Anja Humpert and Michael P. Allen. Propagating director bend fluctuations in nematic liquid crystals. Phys. Rev. Lett., 114, 028301/1–5, 2015. (doi:10.1103/PhysRevLett.114.028301Link opens in a new window).
- [b — ruzicka.s:2015.a]
- Stepan Ruzicka and Michael P. Allen. Monte Carlo Simulation of Kinetically Slowed Down Phase Separation. Euro. Phys. J. E, 38, 68/1–12, 2015. (doi:10.1140/epje/i2015-15068-5Link opens in a new window open access).
- [c — humpert.a:2015.b]
- Anja Humpert and Michael P. Allen. Elastic constants and dynamics in nematic liquid crystals. Mol. Phys., 113, 2680–2692, 2015. (doi:10.1080/00268976.2015.1067730Link opens in a new window).
- [d — ruzicka.s:2015.b]
- Stepan Ruzicka and Michael P. Allen. Monodisperse clusters in charged attractive colloids: linear renormalization of repulsion. J. Chem. Theor. Comput., 11, 3811–3817, 2015. (doi:10.1021/ct501067tLink opens in a new window open access).
- [e — rutter.go:2015.a]
- Gil O. Rutter, Aaron H. Brown, David Quigley, Tiffany R. Walsh and Michael P. Allen. Testing the transferability of a coarse-grained model to intrinsically disordered proteins. Phys. Chem. Chem. Phys., 17, 31741–31749, 2015. (doi:10.1039/c5cp05652gLink opens in a new window).
- [f — ilnytskyi.jm:2015.a]
- Jaroslav M. Ilnytskyi, Marina Saphiannikova, Dieter Neher and Michael P. Allen. Computer Simulation of Side-Chain Liquid Crystal Polymer Melts and Elastomers. Chapter 4, pp 93–129 in Liquid Crystalline Polymers, Eds: Vijay K. Thakur and Michael R. Kessler, Springer International, 2015. (doi:10.1007/978-3-319-22894-5_4Link opens in a new window).
2014
- [a — ruzicka.s:2014.a]
- Stepan Ruzicka and Michael P. Allen. Collective translational and rotational Monte Carlo moves for attractive particles. Phys. Rev. E, 89, 033307/1–19, 2014. (doi:10.1103/PhysRevE.89.033307Link opens in a new window).
- [b — ruzicka.s:2014.b]
- Stepan Ruzicka and Michael P. Allen. Collective translational and rotational Monte Carlo move for general pairwise interaction. Phys. Rev. E, 90, 033302/1–10, 2014. (doi:10.1103/PhysRevE.90.033302Link opens in a new window).
2013
- [a — allehyani.ih:2013.a]
- Ibrahim H. Al-Lehyani, John M. A. Grime, Matthew Bano, Kim McKelvey, and Michael P. Allen. Coarse-grained simulation of transmembrane peptides in the gel phase. J. Comp. Phys., 238, 97–105, 2013. (doi:10.1016/j.jcp.2012.12.014Link opens in a new window).
- [b — allen.mp:2013.a]
- Michael P. Allen and David Quigley. Some comments on Monte Carlo and molecular dynamics methods. Molec. Phys., 111, 3442–3447, 2013. (doi: 10.1080/00268976.2013.817623Link opens in a new window).
- [c — cosseddu.sm:2013.a]
- Salvatore M. Cosseddu, Igor A. Khovanov, Michael P. Allen, P. Mark Rodger, Dmitri G. Luchinsky, and Peter V. E. McClintock. Dynamics of ions in the selectivity filter of the KcsA channel. Euro. Phys. J. Spec. Top., 222, 2595–2605, 2013. (doi: 10.1140/epjst/e2013-02040-9Link opens in a new window).
- [d — vorselaars.b:2017.a]
- Bart Vorselaars, Stepan Ruzicka, David Quigley, and Michael P. Allen. Correction: Folding Kinetics of a Polymer. Phys. Chem. Chem. Phys., 19, 5674–5676, 2017. Published in 2013 as an addition to the original 2012 paper; then republished in 2017 with a DOI (doi:10.1039/c7cp90027aLink opens in a new window).
2012
- [a — swetnam.ad:2012.a]
- Adam D. Swetnam, Charles Brett, and Michael P. Allen. Phase diagrams of knotted and unknotted ring polymers. Phys. Rev. E, 85, 031804/1–11, 2012. (doi:10.1103/PhysRevE.85.031804Link opens in a new window).
- [b — ruzicka.s:2012.a]
- Stepan Ruzicka, David Quigley, and Michael P. Allen. Folding Kinetics of a Polymer. Phys. Chem. Chem. Phys., 14, 6044–6053, 2012. (doi:10.1039/C2CP00051BLink opens in a new window).
- [c — swetnam.ad:2012.b]
- Adam D. Swetnam, and Michael P. Allen. Selective adsorption of lattice peptides on patterned surfaces. Phys. Rev. E, 85, 062901/1–4, 2012. (doi:10.1103/PhysRevE.85.062901Link opens in a new window).
- [d — swetnam.ad:2012.c]
- Adam D. Swetnam, and Michael P. Allen. Studying the Adsorption of Polymers and Biomolecules on Surfaces Using Enhanced Sampling Methods. MRS Online Library, 1470, xx02–06, 2012. (doi:10.1557/opl.2012.1203Link opens in a new window).
- [e — allen.mp:2012.a]
- Michael P. Allen, and Adam D. Swetnam. Wang-Landau Simulations of Adsorbed and Confined Lattice Polymers. Physics Procedia, 34, 6–13, 2012. (doi:10.1016/j.phpro.2012.05.002Link opens in a new window).
- [f — ilnytskyi.jm:2012.a]
- Jaroslav M. Ilnytskyi, Marina Saphiannikova, Dieter Neher, and Michael P. Allen, Modelling elasticity and memory effects in liquid crystalline elastomer by molecular dynamics simulations. Soft Matter, 8, 11123–11134, 2012. (doi:10.1039/C2SM26499DLink opens in a new window).
2011
- [a — swetnam.ad:2011.a]
- Adam D. Swetnam, and Michael P. Allen. Improving the Wang-Landau algorithm for polymers and proteins. J. Comput. Chem., 32, 816–821, 2011. (doi:10.1002/jcc.21660Link opens in a new window).
2010
- [a — obrien.pac:2010.a]
- P. A. C. O'Brien, M. P. Allen, D. L. Cheung, M. Dennison and A. J. Masters. Elastic constants of hard thick platelets by Monte Carlo simulation and virial expansion. Soft Matter, 7, 153-162, 2010. (doi:10.1039/c0sm00541jLink opens in a new window).
2009
- [a — allen.mp:2009.a]
- Michael P. Allen. Molecular simulation methods for soft matter. In Modeling and simulation of new materials, Tenth Granada Lectures (eds: J. Marro, P. L. Garrido and P. I. Hurtado) ISBN 978-0-7354-0624-7, AIP Conference Proceedings, 1091, 1–43, 2009. (doi:10.1063/1.3082281Link opens in a new window).
- [b — swetnam.ad:2009.a]
- Adam D. Swetnam, and Michael P. Allen. Improved simulations of lattice peptide adsorption. Phys. Chem. Chem. Phys., 11, 2046–2055, 2009. (doi:10.1039/b818067aLink opens in a new window).
- [c — dennison.m:2009.a]
- M. Dennison, A. J. Masters, D. L. Cheung, and Michael P. Allen. Calculation of direct correlation function for hard particles using a virial expansion. Molec. Phys., 107, 375–382, 2009. (doi:10.1080/00268970902784934Link opens in a new window).
2008
- [a — tupitsyna.ai:2008.a]
- A. I. Tupitsyna, A. A. Darinskii, I. Emri, and Michael P. Allen. Computer simulation of anisotropic polymer brushes. Soft Matter, 4, 108–121, 2008. (doi:10.1039/b711649gLink opens in a new window).
- [b — cheung.dl:2008.a]
- D. L. Cheung, L. Anton, M. P. Allen, and A. J. Masters. Structure of molecular liquids: Hard rod-disk mixtures. Phys. Rev. E, 77, 011202/1–8, 2008. (doi:10.1103/PhysRevE.77.011202Link opens in a new window).
- [c — cheung.dl:2008.b]
- D. L. Cheung and M. P. Allen. Forces between cylindrical nanoparticles in a liquid crystal. Langmuir, 24, 1411–1417, 2008. (doi:10.1021/la702348cLink opens in a new window).
- [d — cheung.dl:2008.c]
- D. L. Cheung, L. Anton, M. P. Allen, and A. J. Masters. Computer simulation of liquids and liquid crystals. Comput. Phys. Commun., 179, 61–65, 2008. (doi:10.1016/j.cpc.2008.01.029Link opens in a new window).
- [e — smiatek.j:2008.a]
- Jens Smiatek, Michael P. Allen, and Friederike Schmid. Tunable-slip boundaries for coarse-grained simulations of fluid flow. Euro. Phys. J. E, 26, 115–122, 2008. (doi:10.1140/epje/i2007-10311-4Link opens in a new window).
- [f — cheung.dl:2008.d]
- D. L. Cheung and Michael P. Allen. Effect of substrate geometry on liquid-crystal-mediated nanocylinder-substrate interactions. J. Chem. Phys., 129, 114706/1-7, 2008. (doi:10.1063/1.2977968Link opens in a new window).
- [g — cheung.dl:2008.e]
- D. L. Cheung, L. Anton, Michael P. Allen, A. J. Masters, J. Phillips and M. Schmidt. Structure and stability of isotropic states of hard platelet fluids. Phys. Rev. E., 78, 041201/1-13, 2008. (doi:10.1103/PhysRevE.78.041201Link opens in a new window).
- [h — obrien.pa:2008.a]
- P. A. O'Brien, M. P. Allen, D. L. Cheung, M. Dennison and A. J. Masters. Elastic constants of hard thin platelets by Monte Carlo simulation and virial expansion. Phys. Rev. E., 78, 051705/1-7, 2008. (doi:10.1103/PhysRevE.78.051705Link opens in a new window).
2007
- [a — allen.mp:2007.a]
- Michael P. Allen and Friederike Schmid. A thermostat for molecular dynamics of complex fluids. Molec. Simul., 33, 21–26, 2007. (doi:10.1080/08927020601052856Link opens in a new window).
- [b — allen.mp:2007.b]
- Michael P. Allen. Educational aspects of molecular simulation. Molec. Phys., 105, 157–166, 2007. (doi:10.1080/00268970601138721Link opens in a new window).
- [c — cheung.dl:2007.a]
- D. L. Cheung, L. Anton, M. P. Allen, and A. J. Masters. Structure of molecular liquids: Closure relations for hard spheroids. Phys. Rev. E, 76, 041201/1–8, 2007. (doi:10.1103/PhysRevE.76.041201Link opens in a new window).
- [d — cheung.dl:2007.b]
- D. L. Cheung and M. P. Allen. Liquid-crystal-mediated force between a cylindrical nanoparticle and substrate. Phys. Rev. E, 76, 041706/1–7, 2007. (doi:10.1103/PhysRevE.76.041706Link opens in a new window).
- [e — darinskii.aa:2007.a]
- A. A. Darinskii, A. I. Tupitsyna, M. P. Allen, and I. Emri. Liquid crystal transitions induced by spherical particles in anisotropic polymer brushes: Molecular dynamics simulation. Polymer Science Ser A., 49, 944–959, 2007. (doi:10.1134/S0965545X07080123Link opens in a new window).
2006
- [a — allen.mp:2006.a]
- Michael P. Allen. Configurational temperature in membrane simulations using dissipative particle dynamics. J. Phys. Chem. B, 110, 3823–3830, 2006. (doi:10.1021/jp055119eLink opens in a new window).
- [b — allen.mp:2006.b]
- Michael P. Allen. Evaluation of pressure tensor in constant-volume simulations of hard and soft convex bodies. J. Chem. Phys., 124, 214103/1–4, 2006. (doi:10.1063/1.2202352Link opens in a new window).
- [c — cheung.dl:2006.a]
- D. L. Cheung, L. Anton, M. P. Allen, and A. J. Masters. Structure of molecular liquids: Cavity and bridge functions of the hard spheroid fluid. Phys. Rev. E, 73, 061204/1–10, 2006. (doi:10.1103/PhysRevE.73.061204Link opens in a new window).
- [d — cheung.dl:2006.b]
- D. L. Cheung and M. P. Allen. Structure of a liquid crystalline fluid around a macroparticle: Density functional theory. Phys. Rev. E, 74, 021701/1–8, 2006. (doi:10.1103/PhysRevE.74.021701Link opens in a new window).
- [e — allen.mp:2006.c]
- Michael P. Allen and Guido Germano. Expressions for forces and torques in molecular simulations using rigid bodies. Molec. Phys., 104, 3225–3235, 2006. (doi:10.1080/00268970601075238Link opens in a new window).
- [f — allen.mp:2006.d]
- Michael P. Allen. Computer simulation of liquid crystals. In M. Ferrario, G. Ciccotti, and K. Binder, editors, Computer Simulations in Condensed Matter: From Materials to Chemical Biology, volume 704 of Lecture Notes in Physics, pages 191–210, Heidelberg, 2006. Springer. Proceedings of Summer School, Erice, Sicily, July 2005. (doi:10.1007/3-540-35284-8_9Link opens in a new window).
2005
- [a — allen.mp:2005.a]
- Michael P. Allen. Computer simulation of multiscale phenomena in colloidal liquid crystals. Comput. Phys. Commun., 169, 433–437, 2005. (doi:10.1016/j.cpc.2005.03.096Link opens in a new window).
- [b — zadorozhnii.vi:2005.a]
- V. I. Zadorozhnii, I. P. Pinkevich, V. Y. Reshetnyak, and M. P. Allen. Monte Carlo simulation of ferronematic suspensions with three elastic constants. Mol. Cryst. Liq. Cryst., 437, 1487–1494, 2005. (doi:10.1080/15421400590957620Link opens in a new window).
- [c — allen.mp:2005.b]
- Michael P. Allen. Spin dynamics for the Lebwohl-Lasher model. Phys. Rev. E, 72, 036703, 2005. (doi:10.1103/PhysRevE.72.036703Link opens in a new window).
2004
- [a — downton.mt:2004.a]
- M. T. Downton and Michael P. Allen. Computer simulation of liquid crystal surface modification. Europhys. Lett., 65, 48–54, 2004. (doi:10.1209/epl/i2003-10046-xLink opens in a new window).
- [b — allen.mp:2004.a]
- Michael P. Allen. Introduction to molecular dynamics simulation. In N. Attig, K. Binder, H. Grubmüller, and K. Kremer, editors, Computational soft matter: from synthetic polymers to proteins, volume 23 of NIC Series, pages 1–27, Jülich, 2004. John von Neumann Institute for Computing, NIC-Directors. (ISBN: 3-00-012641-4Link opens in a new window, open accessLink opens in a new window).
- [c — allen.mp:2004.b]
- Michael P. Allen. Liquid crystal systems. In N. Attig, K. Binder, H. Grubmüller, and K. Kremer, editors, Computational soft matter: from synthetic polymers to proteins, volume 23 of NIC Series, pages 289–320, Jülich, 2004. John von Neumann Institute for Computing, NIC-Directors. (ISBN: 3-00-012641-4Link opens in a new window, open accessLink opens in a new window).
- [d — albarwani.ms:2004.a]
- M. S. Al-Barwani, G. S. Sutcliffe, and Michael P. Allen. Forces between two colloidal particles in a nematic solvent. J. Phys. Chem. B, 108, 6663–6666, 2004. (doi:10.1021/jp037650kLink opens in a new window).
- [e — west.jl:2004.a]
- J. L. West, K. Zhang, G. X. Liao, A. V. Glushchenko, Y. Reznikov, D. Andrienko, and M. P. Allen. Mechanism of formation of three dimensional structures of particles in a liquid crystal. Mol. Cryst. Liq. Cryst., 410, 611–621, 2004. (doi:10.1080/15421400490436124Link opens in a new window).
2003
- [a — allen.mp:2003.a]
- Michael P. Allen. Simulation and theory of inhomogeneous liquid crystals. In M. Ristig and K. Gernoth, editors, Particle Scattering, X-Ray diffraction, and Microstructure of solids and liquids, volume 610 of Lecture Notes in Physics, pages 101–131. Springer-Verlag, Berlin, 2003. (doi:10.1007/3-540-45881-6_5Link opens in a new window).
- [b — andrienko.d:2003.a]
- D. Andrienko, M. Tasinkevych, P. Patricio, Michael P. Allen, and M. M. Telo da Gama. Forces between elongated particles in a nematic colloid. Phys. Rev. E, 68, 051702/1–5, 2003. (doi:10.1103/PhysRevE.68.051702Link opens in a new window).
2002
- [a — andrienko.d:2002.a]
- Denis Andrienko and Michael P. Allen. Theory and simulation of the nematic zenithal anchoring coefficient. Phys. Rev. E, 65, 021704/1–11, 2002. (doi:10.1103/PhysRevE.65.021704Link opens in a new window).
- [b — andrienko.d:2002.b]
- Denis Andrienko, Michael P. Allen, Gregor Skacej, and Slobodan Zumer. Defect structures and torque on an elongated colloidal particle immersed in a liquid crystal host. Phys. Rev. E, 65, 041702/1–7, 2002. (doi:10.1103/PhysRevE.65.041702Link opens in a new window).
- [c — germano.g:2002.a]
- Guido Germano, Michael P. Allen, and Andrew J. Masters. Simultaneous calculation of the helical pitch and the twist elastic constant in chiral liquid crystals from intermolecular torques. J. Chem. Phys., 116, 9422–9430, 2002. (doi:10.1063/1.1475747Link opens in a new window).
- [d — west.jl:2002.a]
- J. L. West, A. Glushchenko, G. X. Liao, Y. Reznikov, D. Andrienko, and Michael P. Allen. Drag on particles in a nematic suspension by a moving nematic-isotropic interface. Phys. Rev. E, 66, 012702, 2002. (doi:10.1103/PhysRevE.66.012702Link opens in a new window).
- [e — theenhaus.t:2002.a]
- T. Theenhaus, Michael P. Allen, M. Letz, A. Latz, and R. Schilling. Dynamical precursor of nematic order in a dense fluid of hard ellipsoids of revolution. Euro. Phys. J. E, 8, 269–274, 2002. (doi:10.1140/epje/i2001-10093-7Link opens in a new window).
2001
- [a — allen.mp:2001.a]
- Michael P. Allen. Molecular simulations and coarse-grained theories of liquid crystals. In A. Brandt, J. Bernholc, and K. Binder, editors, Multiscale computational methods in chemistry and physics, volume 177 of NATO Science Series III: Computer and systems sciences, pages 226–228. IOS press, Amsterdam, 2001. Proceedings of the NATO Advanced Research Workshop `Multiscale computational methods in chemistry and physics', Eilat, Israel, April 5-7, 2000 (ISBN: 978-1-58603-141-1).
- [b — andrienko.d:2001.a]
- Denis Andrienko, Guido Germano, and Michael P. Allen. Computer simulation of topological defects around a colloidal particle or droplet dispersed in a nematic host. Phys. Rev. E, 63, 041701/1–8, 2001. (doi:10.1103/PhysRevE.63.041701Link opens in a new window).
- [c — akino.n:2001.a]
- Nobuhiko Akino, Friederike Schmid, and Michael P. Allen. Molecular dynamics study of the nematic-isotropic interface. Phys. Rev. E, 63, 041706/1–6, 2001. (doi:10.1103/PhysRevE.63.041706Link opens in a new window).
- [d — allen.mp:2001.b]
- Michael P. Allen and Andrew J. Masters. Molecular simulation and theory of liquid crystals: chiral parameters, flexoelectric coefficients, and elastic constants. J. Mater. Chem., 11, 2678–2689, 2001. (doi:10.1039/b103900hLink opens in a new window).
- [e — allen.mp:2001.c]
- Michael P. Allen. Statistical mechanical simulations. In J. H. Moore and N. D. Spencer, editors, Encyclopedia of Chemical Physics and Physical Chemistry, volume 2, chapter B3.3, pages 1983–2025. Institute of Physics Publishing, Bristol, 2001 (ISBN: 9780750303132).
- [f — allen.mp:2001.d]
- Michael P. Allen. Molecular simulations and theory of planar interfaces and defects in nematic liquid crystals. In O. D. Lavrentovich, P. Pasini, C. Zannoni, and S. Zumer, editors, Defects in Liquid Crystals: Computer Simulations, Theory and Experiments, volume 43 of NATO Science Series II, pages 113–139. Kluwer Academic Publishers, Dordrecht, 2001. Proceedings of the NATO Advanced Research Workshop `Computer Simulations of Defects in Liquid Crystals including their relation to Theory and Experiment', Erice, Italy, September 19-23, 2000. (doi:10.1007/978-94-010-0512-8_5Link opens in a new window).
2000
- [a — allen.mp:2000.a]
- Michael P. Allen. Introduction to simulations and statistical mechanics. In C. Zannoni and P. Pasini, editors, Advances in the Computer Simulations of Liquid Crystals, volume 545 of NATO ASI Series C, pages 1–16. Kluwer Academic Publishers, Dordrecht, 2000. Proceedings of the NATO Advanced Study Institute `Advances in the Computer Simulations of Liquid Crystals', Erice, Italy, June 11-21, 1998. (doi:10.1007/978-94-011-4225-0_1Link opens in a new window).
- [b — allen.mp:2000.b]
- Michael P. Allen. Modelling liquid crystal structure, phase behaviour and large-scale phenomena. In C. Zannoni and P. Pasini, editors, Advances in the Computer Simulations of Liquid Crystals, volume 545 of NATO ASI Series C, pages 73–97. Kluwer Academic Publishers, Dordrecht, 2000. Proceedings of the NATO Advanced Study Institute `Advances in the Computer Simulations of Liquid Crystals', Erice, Italy, June 11-21, 1998. (doi:10.1007/978-94-011-4225-0_4Link opens in a new window).
- [c — andrienko.d:2000.b]
- Denis Andrienko and Michael P. Allen. Molecular simulation and theory of a liquid crystalline disclination core. Phys. Rev. E, 61, 504–510, 2000. (doi:10.1103/PhysRevE.61.504Link opens in a new window).
- [d — allen.mp:2000.c]
- Michael P. Allen. Molecular simulation and theory of the isotropic-nematic interface. J. Chem. Phys., 112, 5447–5453, 2000. (doi:10.1063/1.481112Link opens in a new window).
- [e — allen.mp:2000.d]
- Michael P. Allen. Long-range behaviour in liquid crystals by computer simulation. J. Molec. Liquids, 85, 161–171, 2000. (doi:10.1016/S0167-7322(99)00172-5Link opens in a new window).
- [f — mills.sj:2000.a]
- Stuart J. Mills, Christopher M. Care, Maureen P. Neal, Mark R. Wilson, Michael P. Allen, and Douglas J. Cleaver. Formation of a nematic monodomain in a model liquid crystal film. J. Molec. Liquids, 85, 185–195, 2000. (doi:10.1016/S0167-7322(99)00176-2Link opens in a new window).
- [g — vanduijneveldt.js:2000.a]
- J. S. van Duijneveldt, A. Gilvillegas, G. Jackson, and Michael P. Allen. Simulation study of the phase behavior of a primitive model for thermotropic liquid crystals: Rodlike molecules with terminal dipoles and flexible tails. J. Chem. Phys., 112, 9092–9104, 2000. (doi:10.1063/1.481520Link opens in a new window).
- [h — andrienko.d:2000.c]
- Denis Andrienko, Guido Germano, and Michael P. Allen. Liquid crystal director fluctuations and surface anchoring by molecular simulation. Phys. Rev. E, 62, 6688–6693, 2000. (doi:10.1103/PhysRevE.62.6688Link opens in a new window).
- [i — albarwani.ms:2000.a]
- Muataz S. Al-Barwani and Michael P. Allen. Isotropic-nematic interface of soft spherocylinders. Phys. Rev. E, 62, 6706–6710, 2000. (doi:10.1103/PhysRevE.62.6706Link opens in a new window).
- [j — allen.mp:2000.e]
- Michael P. Allen. Pressure tensor profiles at the isotropic-nematic interface. Chem. Phys. Lett., 331, 513–518, 2000. (doi:10.1016/S0009-2614(00)01207-0Link opens in a new window).
- [k — mcdonald.aj:2000.a]
- Andrew J. McDonald, Michael P. Allen, and Friederike Schmid. Surface tension of the isotropic-nematic interface. Phys. Rev. E, 63, 010701(R)/1–4, 2000. (doi:10.1103/PhysRevE.63.010701Link opens in a new window).
1999
- [a — dominguez.h:1999.a]
- Hector Dominguez, Michael P. Allen, and Robert Evans. Monte Carlo studies of the freezing and condensation transitions of confined fluids. Molec. Phys., 96, 209–229, 1999. (doi:10.1080/002689799165846Link opens in a new window).
- [b — allen.mp:1999.a]
- Michael P. Allen. Molecular simulation and theory of liquid crystal surface anchoring. Molec. Phys., 96, 1391–1397, 1999. (doi:10.1080/002689799164621Link opens in a new window).
- [c — wilson.mr:1999.a]
- Mark R. Wilson, Michael P. Allen, Maureen P. Neal, Christopher M. Care, and Douglas J. Cleaver. Computer simulation of liquid crystals on the T3D/T3E. In R. J. Allan, M. F. Guest, A. D. Simpson, D. S. Henty, and D. A. Nicole, editors, High-Performance Computing, pages 193–202. Kluwer Academic / Plenum Publishers, New York, 1999. Proceedings of the HPCI conference, Manchester, England, January 12-14, 1998 (doi:10.1007/978-1-4615-4873-7_21Link opens in a new window).
- [d — camp.pj:1999.a]
- P. J. Camp, Michael P. Allen, and A. J. Masters. Theory and computer simulation of bent-core molecules. J. Chem. Phys., 111, 9871–9881, 1999. (doi:10.1063/1.480324Link opens in a new window).
- [e — allen.mp:1999.b]
- Michael P. Allen. Simulations and theories of liquid crystals. Comput. Phys. Commun., 122, 219–224, 1999. (doi:10.1016/S0010-4655(99)00317-3Link opens in a new window).
1998
- [a — allen.mp:1998.a]
- Michael P. Allen, M. A. Warren, and M. R. Wilson. Molecular dynamics simulation of the smectic-A* twist grain-boundary phase. Phys. Rev. E, 57, 5585–5596, 1998. (doi:10.1103/PhysRevE.57.5585Link opens in a new window).
- [b — brown.jt:1998.a]
- J. T. Brown, Michael P. Allen, E. Martín del Río, and E. de Miguel. Effects of elongation on the phase behavior of the Gay-Berne fluid. Phys. Rev. E, 57, 6685–6699, 1998. (doi:10.1103/PhysRevE.57.6685Link opens in a new window).
- [c — lyulin.av:1998.a]
- Alexey V. Lyulin, Muataz S. Al-Barwani, Michael P. Allen, Mark R. Wilson, Igor Neelov, and Nicholas K. Allsopp. Molecular dynamics simulation of main chain liquid crystalline polymers. Macromolecules, 31, 4626–4634, 1998. (doi:10.1021/ma971105yLink opens in a new window).
1997
- [a — vanduijneveldt.js:1997.a]
- Jeroen S. van Duijneveldt and Michael P. Allen. Free energy barriers for interlayer diffusion in the smectic-A phase of hard spherocylinders. Molec. Phys., 90, 243–250, 1997. (doi:10.1080/002689797172723Link opens in a new window).
- [b — allen.mp:1997.a]
- Michael P. Allen and Mark A. Warren. Simulation of structure and dynamics near the isotropic-nematic transition. Phys. Rev. Lett., 78, 1291–1294, 1997. (doi:10.1103/PhysRevLett.78.1291Link opens in a new window).
- [c — wilson.mr:1997.b]
- M. R. Wilson, Michael P. Allen, M. A. Warren, A. Sauron, and W. Smith. Replicated data and domain decomposition molecular dynamics techniques for simulation of anisotropic potentials. J. Comput. Chem., 18, 478–488, 1997. (doi:10.1002/(SICI)1096-987X(199703)18:4<478::AID-JCC3>3.0.CO;2-QLink opens in a new window).
- [d — yuan.xf:1997.a]
- Xue-Feng Yuan and Michael P. Allen. Non-linear responses of the hard spheroid fluid under shear flow. Physica A, 240, 145–159, 1997. (doi:10.1016/S0378-4371(97)00137-4Link opens in a new window).
- [e — camp.pj:1997.b]
- P. J. Camp and Michael P. Allen. Phase diagram of the hard biaxial ellipsoid fluid. J. Chem. Phys., 106, 6681–6688, 1997. (doi:10.1063/1.473665Link opens in a new window).
- [f — camp.pj:1997.c]
- Philip J. Camp, Michael P. Allen, Peter G. Bolhuis, and Daan Frenkel. Demixing in hard ellipsoid rod-plate mixtures. J. Chem. Phys., 106, 9270–9275, 1997. (doi:10.1063/1.474012Link opens in a new window).
- [g — vanduijneveldt.js:1997.b]
- J. S. van Duijneveldt and Michael P. Allen. Computer simulation study of a flexible-rigid-flexible model for liquid crystals. Molec. Phys., 92, 855–870, 1997. (doi:10.1080/002689797169808Link opens in a new window).
1996
- [a — cleaver.dj:1996.a]
- Douglas J. Cleaver, Samo Kralj, Timothy J. Sluckin, and Michael P. Allen. The random anisotropy nematic spin model. In G. P. Crawford and S. Zumer, editors, Liquid crystals in complex geometries formed by polymer and porous networks, pages 467–481. Taylor and Francis, London, 1996. (doi:10.1201/9781482272796Link opens in a new window).
- [b — allen.mp:1996.a]
- Michael P. Allen. Molecular dynamics for hard particles. In K. Binder and G. Ciccotti, editors, Monte Carlo and molecular dynamics of condensed matter systems, volume 49, chapter 3, pages 89–105. Italian Physical Society, Bologna, 1996. Proceedings of the Euroconference on `Computer simulation in condensed matter physics and chemistry', Como, Italy, July 3-28, 1995. (ISBN: 9788877940780).
- [c — allen.mp:1996.b]
- Michael P. Allen. Simulation and phase diagrams. In K. Binder and G. Ciccotti, editors, Monte Carlo and molecular dynamics of condensed matter systems, volume 49, chapter 10, pages 255–284. Italian Physical Society, Bologna, 1996. Proceedings of the Euroconference on `Computer simulation in condensed matter physics and chemistry', Como, Italy, July 3-28, 1995. (ISBN: 9788877940780).
- [d — camp.pj:1996.a]
- Philip J. Camp and Michael P. Allen. Hard ellipsoid rod-plate mixtures: Onsager theory and computer simulations. Physica A, 229, 410–427, 1996. (doi:10.1016/0378-4371(96)00050-7Link opens in a new window).
- [e — cleaver.dj:1996.b]
- D. J. Cleaver, C. M. Care, M. P. Allen, and M. P. Neal. Extension and generalization of the Gay-Berne potential. Phys. Rev. E, 54, 559–567, 1996. (doi:10.1103/PhysRevE.54.559Link opens in a new window).
- [f — camp.pj:1996.b]
- Philip J. Camp, Carl P. Mason, Michael P. Allen, Anjali A. Khare, and David A. Kofke. The isotropic-nematic transition in uniaxial hard ellipsoid fluids: coexistence data and the approach to the Onsager limit. J. Chem. Phys., 105, 2837–2849, 1996. (doi:10.1063/1.472146Link opens in a new window).
- [g — allen.mp:1996.c]
- Michael P. Allen, Mark A. Warren, Mark. R. Wilson, Alain Sauron, and William Smith. Molecular dynamics calculation of elastic constants in Gay-Berne nematic liquid crystals. J. Chem. Phys., 105, 2850–2858, 1996. (doi:10.1063/1.472147Link opens in a new window).
- [h — demiguel.e:1996.a]
- E. de Miguel, E. Martín del Río, J. T. Brown, and Michael P. Allen. Effect of the attractive interactions on the phase behavior of the Gay-Berne liquid crystal model. J. Chem. Phys., 105, 4234–4249, 1996. (doi:10.1063/1.472292Link opens in a new window).
- [i — camp.pj:1996.c]
- Philip J. Camp and Michael P. Allen. Phase coexistence in a pseudo Gibbs ensemble. Molec. Phys., 88, 1459–1469, 1996. (doi:10.1080/00268979650025551Link opens in a new window).
- [j — allen.mp:1996.d]
- Michael P. Allen. Computer experiments on liquid crystals. Technical report, EPSRC Highlights in Physics, 1996.
- [k — allen.mp:1996.e]
- Michael P. Allen, Julian T. Brown, and Mark A. Warren. Computer simulation of liquid crystals. J. Phys. Cond. Mat., 8, 9433–9437, 1996. (doi:10.1088/0953-8984/8/47/041Link opens in a new window).
- [l — allen.mp:1996.f]
- Michael P. Allen, Philip J. Camp, Carl P. Mason, Glenn T. Evans, and Andrew J. Masters. Viscosity of isotropic hard particle fluids. J. Chem. Phys., 105, 11175–11182, 1996. (doi:10.1063/1.472916Link opens in a new window).
1995
- [a — tang.s:1995.a]
- Shuang Tang, Glenn T. Evans, Carl P. Mason, and Michael P. Allen. Shear viscosity for fluids of hard ellipsoids: a kinetic theory and molecular dynamics study. J. Chem. Phys., 102, 3794–3811, 1995. (doi:10.1063/1.468561Link opens in a new window).
- [b — allen.mp:1995.a]
- Michael P. Allen. Introduction to Monte Carlo simulation. In M. Baus, L. F. Rull, and J. P. Ryckaert, editors, Observation, Prediction and Simulation of Phase Transitions in Complex Fluids, volume 460 of NATO ASI Series C, pages 339–356. Kluwer Academic Publishers, Dordrecht, 1995. Proceedings of the NATO Advanced Study Institute and Enrico Fermi Course LXXIX on `Observation and Prediction of Phase Transitions in Complex Fluids', Varenna, Italy, July 25-August 8, 1994. (doi:10.1007/978-94-011-0065-6_8Link opens in a new window).
- [c — allen.mp:1995.b]
- Michael P. Allen. Simulations and phase behaviour of liquid crystals. In M. Baus, L. F. Rull, and J. P. Ryckaert, editors, Observation, Prediction and Simulation of Phase Transitions in Complex Fluids, volume 460 of NATO ASI Series C, pages 557–591. Kluwer Academic Publishers, Dordrecht, 1995. Proceedings of the NATO Advanced Study Institute and Enrico Fermi Course LXXIX on `Observation and Prediction of Phase Transitions in Complex Fluids', Varenna, Italy, July 25-August 8, 1994. (doi:10.1007/978-94-011-0065-6_13Link opens in a new window).
- [e — allen.mp:1995.c]
- Michael P. Allen, Mark Warren, Mark Wilson, Alain Sauron, and William Smith. Computer simulation of liquid crystals on the T3D. CCP5 Quarterly, 43, February 1995. (Available onlineLink opens in a new window)
- [f — allen.mp:1995.d]
- M. P. Allen, C. P. Mason, E. de Miguel, and J. Stelzer. Structure of molecular liquids. Phys. Rev. E, 52, R25–R28, 1995. (doi:10.1103/PhysRevE.52.R25Link opens in a new window).
- [g — allen.mp:1995.e]
- Michael P. Allen and Carl P. Mason. Stability of the nematic phase for the hard ellipsoid fluid. Molec. Phys., 86, 467–474, 1995. (doi:10.1080/00268979509413624Link opens in a new window).
- [h — allen.mp:1995.f]
- Michael P. Allen. Computer simulation of liquid crystals. Technical Report 3, Flying High: Newsletter of CINECA's ICARUS Project, January 1995.
- [i — allen.mp:1995.g]
- Michael P. Allen. The CCP5 spring school. CCP5 Quarterly, 44, July 1995. (Available onlineLink opens in a new window).
1994
- [a — samborski.a:1994.a]
- Adam Samborski, Glenn T. Evans, Carl P. Mason, and Michael P. Allen. The isotropic to nematic liquid crystal transition for hard ellipsoids: an Onsager-like theory and computer simulations. Molec. Phys., 81, 263–276, 1994. (doi:10.1080/00268979400100181Link opens in a new window).
- [b — allen.mp:1994.a]
- Michael P. Allen, D. Brown, and A. J. Masters. Use of the McQuarrie equation for the computation of shear viscosity via equilibrium molecular dynamics - comment. Phys. Rev. E, 49, 2488–2492, 1994. (doi:10.1103/PhysRevE.49.2488Link opens in a new window).
- [c — allen.mp:1994.b]
- Michael P. Allen. Comment on `Relationship between McQuarrie and Helfand equations for the determination of shear viscosity from equilibrium molecular dynamics'. Phys. Rev. E, 50, 3277–3279, 1994. (doi:10.1103/PhysRevE.50.3277Link opens in a new window).
- [d — allen.mp:1994.c]
- Michael P. Allen. Methods in molecular simulation CCP5 spring school 11–15 april. CCP5 Quarterly, 41, May 1994. (Available onlineLink opens in a new window).
1993
- [a — allen.mp:1993.a]
- Michael P. Allen. Simulation of condensed phases using the Distributed Array Processor. Theor. Chim. Acta, 84, 399–411, 1993. Parallel Computing in Chemical Physics, Chicago 1991. (doi:10.1007/BF01113278Link opens in a new window).
- [b — allen.mp:1993.b]
- Michael P. Allen and Dominic J. Tildesley, editors. Computer simulation in chemical physics, volume 397 of NATO ASI Series C. Kluwer Academic Publishers, Dordrecht, 1993. 519pp. Proceedings of the NATO Advanced Study Institute on `New Perspectives on Computer Simulation in Chemical Physics', Alghero, Sardinia, Italy, September 14-24, 1992. (doi:10.1007/978-94-011-1679-4Link opens in a new window).
- [c — allen.mp:1993.c]
- Michael P. Allen. Back to basics. In Michael P. Allen and Dominic J. Tildesley, editors, Computer simulation in chemical physics, volume 397 of NATO ASI Series C, pages 49–92. Kluwer Academic Publishers, Dordrecht, 1993. Proceedings of the NATO Advanced Study Institute on `New Perspectives on Computer Simulation in Chemical Physics', Alghero, Sardinia, Italy, September 14-24, 1992. (doi:10.1007/978-94-011-1679-4_3Link opens in a new window).
- [d — allen.mp:1993.d]
- Michael P. Allen and Andrew J. Masters. Computer simulation of a twisted nematic liquid crystal. Molec. Phys., 79, 277–289, 1993. (doi:10.1080/00268979300101211Link opens in a new window).
- [e — allen.mp:1993.e]
- Michael P. Allen and Andrew J. Masters. Some notes on Einstein relationships. Molec. Phys., 79, 435–443, 1993. (doi:10.1080/00268979300101331Link opens in a new window).
- [f — allen.mp:1993.f]
- Michael P. Allen. Calculating the helical twisting power of dopants in a liquid crystal by computer simulation. Phys. Rev. E, 47, 4611–4614, 1993. (doi:10.1103/PhysRevE.47.4611Link opens in a new window).
- [g — allen.mp:1993.g]
- Michael P. Allen. Simulations using hard particles. Phil. Trans. Roy. Soc. A, 344, 323–337, 1993. Theme Issue: Understanding Self-assembly and Organization in Liquid Crystals. (doi:10.1098/rsta.1993.0093Link opens in a new window).
- [h — cleaver.dj:1993.a]
- Douglas J. Cleaver and Michael P. Allen. Computer simulation of liquid crystal films. Molec. Phys., 80, 253–276, 1993. (doi:10.1080/00268979300102251Link opens in a new window).
- [i — wilson.mr:1993.a]
- Mark R. Wilson and Michael P. Allen. A computer simulation study of liquid crystal formation in a semi-flexible system of linked hard spheres. Molec. Phys., 80, 277–295, 1993. (doi:10.1080/00268979300102261Link opens in a new window).
- [j — allen.mp:1993.h]
- Michael P. Allen, Glenn T. Evans, Daan Frenkel, and Bela Mulder. Hard convex body fluids. Adv. Chem. Phys., 86, 1–166, 1993. (doi:10.1002/9780470141458.ch1Link opens in a new window).
- [k — bereolos.p:1993.a]
- Peter Bereolos, Julian Talbot, Michael P. Allen, and Glenn T. Evans. Transport properties of the hard ellipsoid fluid. J. Chem. Phys., 99, 6087–6097, 1993. (doi:10.1063/1.466221Link opens in a new window).
1992
- [a — tjiptomargo.b:1992.a]
- Broto Tjipto-Margo, Glenn T. Evans, Michael P. Allen, and Daan Frenkel. Elastic constants of hard and soft nematic liquid crystals. J. Phys. Chem., 96, 3942–3948, 1992. (doi:10.1021/j100189a007Link opens in a new window).
- [b — wilson.mr:1992.a]
- M. R. Wilson and M. P. Allen. Structure of trans-4-( trans-4-n-pentylcyclohexyl) cyclohexylcarbonitrile (CCH5) in the isotropic and nematic phases: a computer simulation study. Liq. Cryst., 12, 157–176, 1992. (doi:10.1080/02678299208029045Link opens in a new window).
- [c — demiguel.e:1992.a]
- E. de Miguel and Michael P. Allen. Hard ellipsoids of revolution with square wells: a comparison between computer simulation and theory in the liquid-vapor region. Molec. Phys., 76, 1275–1279, 1992. (doi:10.1080/00268979200102061Link opens in a new window).
1991
- [a — cleaver.dj:1991.a]
- Douglas J. Cleaver and Michael P. Allen. Computer simulations of the elastic properties of liquid crystals. Phys. Rev. A, 43, 1918–1931, 1991. (doi:10.1103/PhysRevA.43.1918Link opens in a new window).
- [b — wilson.mr:1991.a]
- M. R. Wilson and M. P. Allen. Computer simulations of mesogenic molecules using realistic atom-atom potentials. Mol. Cryst. Liq. Cryst., 198, 465–477, 1991. (doi:10.1080/00268949108033422Link opens in a new window).
- [c — hess.s:1991.a]
- Siegfried Hess, Daan Frenkel, and Michael P. Allen. On the anisotropy of diffusion in nematic liquid crystals: test of a modified affine transformation model via molecular dynamics. Molec. Phys., 74, 765–774, 1991. (doi:10.1080/00268979100102561Link opens in a new window).
- [d — allen.mp:1991.a]
- Michael P. Allen. Computer simulation of liquid crystals. CCP5 Quarterly, 33, January 1991. (Available onlineLink opens in a new window).
- [e — allen.mp:1991.b]
- Michael P. Allen and Martyn F. Guest. Scientific achievements of the Computational Science Initiative. 1991. 140pp.
1990
- [a — allen.mp:1990.a]
- Michael P. Allen and Daan Frenkel. Calculation of liquid crystal Frank constants by computer simulation. Phys. Rev. A, 42, 3641, 1990. Erratum. (doi:10.1103/PhysRevA.42.3641Link opens in a new window).
- [b — talbot.j:1990.b]
- Julian Talbot, Daniel Kivelson, Michael P. Allen, Glenn T. Evans, and Daan Frenkel. Structure of the hard ellipsoid fluid. J. Chem. Phys., 92, 3048–3057, 1990. (doi:10.1063/1.457902Link opens in a new window).
- [c — allen.mp:1990.b]
- Michael P. Allen. Computer simulation of a biaxial liquid crystal. Liq. Cryst., 8, 499–511, 1990. (doi:10.1080/02678299008047365Link opens in a new window).
- [d — talbot.j:1990.c]
- Julian Talbot, Daniel Kivelson, Gilles Tarjus, Michael P. Allen, and Glenn T. Evans. Short-time correlations in liquids: Molecular-dynamic simulations of hard spheroids. Phys. Rev. Lett., 65, 2828–2831, 1990. (doi:10.1103/PhysRevLett.65.2828Link opens in a new window).
- [e — telodagama.mm:1990.b]
- Margarida M. Telo da Gama, Pedro Tarazona, Michael P. Allen, and Robert Evans. The effect of confinement on the isotropic-nematic transition. Molec. Phys., 71, 801–821, 1990. (doi:10.1080/00268979000102121Link opens in a new window).
- [f — allen.mp:1990.c]
- Michael P. Allen. Diffusion coefficient increases with density in hard ellipsoid liquid crystals. Phys. Rev. Lett., 65, 2881–2884, 1990. (doi:10.1103/PhysRevLett.65.2881Link opens in a new window).
- [g — catlow.cra:1990.a]
- C. Richard A. Catlow, Steven C. Parker, and Michael P. Allen, editors. Computer simulation of fluids, polymers and solids, volume 293 of NATO ASI Series C, Dordrecht, 1990. Kluwer Academic Publishers. (doi:10.1007/978-94-009-2484-0Link opens in a new window).
- [h — allen.mp:1990.d]
- Michael P. Allen, David M. Heyes, Maurice Leslie, Sarah L. Price, William Smith, and Dominic J. Tildesley. Computer simulation exercises. In C. Richard A. Catlow, Steven C. Parker, and Michael P. Allen, editors, Computer simulation of fluids, polymers and solids, volume 293 of NATO ASI Series C, pages 431–536. Kluwer Academic Publishers, Dordrecht, 1990. Proceedings of the NATO Advanced Study Institute on `Computer simulation of fluids, polymers and solids', Bath, U.K., September 4-17, 1988. (Available online under the heading Back Matter at doi:10.1007/978-94-009-2484-0Link opens in a new window).
1989
- [a — allen.mp:1989.a]
- Michael P. Allen. Molecular graphics and the computer simulation of liquid crystals. Molec. Simul., 2, 301–306, 1989. (doi:10.1080/08927028908034607Link opens in a new window).
- [b — walker.pam:1989.a]
- P. Alexandra M. Walker and Michael P. Allen. A simulation study of ammonium nitrate in aqueous solution. Molec. Simul., 2, 307–312, 1989. (doi:10.1080/08927028908034608Link opens in a new window).
- [c — talbot.j:1989.a]
- Julian Talbot, Michael P. Allen, Glenn T. Evans, Daan Frenkel, and Daniel Kivelson. Accuracy of Enskog theory for rotational versus translational motion: A molecular-dynamics study. Phys. Rev. A, 39, 4330–4332, 1989. (doi:10.1103/PhysRevA.39.4330Link opens in a new window).
- [d — allen.mp:1989.b]
- M. P. Allen, D. Frenkel, and J. Talbot. Molecular dynamics simulation using hard particles. Comput. Phys. Rep., 9, 301–353, 1989. (doi:10.1016/0167-7977(89)90009-9Link opens in a new window).
- [e — allen.mp:1989.c]
- Michael P. Allen. A molecular dynamics simulation study of rigid and non-rigid hard dumb-bells. Molec. Simul., 3, 251–261, 1989. (doi:10.1080/08927028908031378Link opens in a new window).
- [f — allen.mp:1989.d]
- Michael P. Allen. Computer simulation of liquid crystal films. Molec. Simul., 4, 61–78, 1989. (doi:10.1080/08927028908021965Link opens in a new window).
- [g — allen.mp:1989.e]
- Michael P. Allen and Kathryn Armitstead. Studies of adsorbed monolayers using a spatially-coupled Potts model. J. Phys. A Math. Gen., 22, 3011–3021, 1989. (doi:10.1088/0305-4470/22/15/017Link opens in a new window).
- [h — allen.mp:1989.f]
- Michael P. Allen. A theoretical study of the Lebwohl-Lasher model in higher dimensions. Molec. Phys., 68, 181–189, 1989. (doi:10.1080/00268978900102041Link opens in a new window).
- [i — allen.mp:1989.g]
- Michael P. Allen and Mark R. Wilson. Computer simulation of liquid crystals. J. Computer-Aided Molec. Des., 3, 335–353, 1989. (doi:10.1007/BF01532020Link opens in a new window).
- [j — allen.mp:1989.h]
- Michael P. Allen. Quaternion quickie. CCP5 Quarterly, 31, October 1989. (Available onlineLink opens in a new window).
- [k — allen.mp:1989.i]
- Michael P. Allen and Dominic J. Tildesley. Error in "computer simulation of liquids". CCP5 Quarterly, 31, October 1989. (Available onlineLink opens in a new window).
- [l — allen.mp:1989.j]
- Michael P. Allen and Dominic J. Tildesley. Computer simulation of liquids. Clarendon Press, Oxford, paperback edition, 1989. (ISBN: 9780198556459).
1988
- [a — allen.mp:1988.a]
- Michael P. Allen and Daan Frenkel. Calculation of liquid crystal Frank constants by computer simulation. Phys. Rev. A, 37, 1813–1816, 1988. (doi:10.1103/PhysRevA.37.1813Link opens in a new window).
- [b — allen.mp:1988.b]
- Michael P. Allen. Path integral simulation of rotors. CCP5 Quarterly, 29, November 1988. (Available onlineLink opens in a new window).
1987
- [a — allen.mp:1987.a]
- Michael P. Allen and Anthony A. Imbierski. A molecular dynamics study of the hard dumb-bell system. Molec. Phys., 60, 453–473, 1987. (doi:10.1080/00268978700100301Link opens in a new window).
- [b — allen.mp:1987.b]
- Michael P. Allen and Daan Frenkel. Observation of dynamical precursors of the isotropic-nematic transition by computer simulation. Phys. Rev. Lett., 58, 1748–1750, 1987. (doi:10.1103/PhysRevLett.58.1748Link opens in a new window).
- [c — allen.mp:1987.c]
- Michael P. Allen and Seamus F. O'Shea. A Monte Carlo simulation study of orientational domain clusters in the planar quadrupole model. Molec. Simul., 1, 47–66, 1987. (doi:10.1080/08927028708080930Link opens in a new window).
- [d — allen.mp:1987.d]
- Michael P. Allen and Dominic J. Tildesley. Computer simulation of liquids. Clarendon Press, Oxford, hardback edition, 1987. (ISBN: 9780198553755).
1986
- [a — allen.mp:1986.a]
- Michael P. Allen and Gisele Maréchal. Nonequilibrium molecular dynamics simulation of a molecular fluid subjected to an oscillatory perturbation. Molec. Phys., 57, 7–19, 1986. (doi:10.1080/00268978600100011Link opens in a new window).
- [b — allen.mp:1986.b]
- Michael P. Allen and Ian C. H. Cunningham. A computer simulation study of idealized model tetrahedral molecules. Molec. Phys., 58, 615–625, 1986. (doi:10.1080/00268978600101421Link opens in a new window).
- [c — allen.mp:1986.c]
- Michael P. Allen and Daan Frenkel. Molecular dynamics simulation of hard molecules. CCP5 Quarterly, 23, December 1986. (Available onlineLink opens in a new window).
1985
- [a — allen.mp:1985.a]
- Michael P. Allen, Charles B. Hovenden, Richard P. Humes, Sant K. Mehta, Robert K. Thomas, and Mary A. White. Neutron scattering spectra from the hindered rotation of methane in methane + krypton mixtures adsorbed on graphite. Faraday Disc. Chem. Soc., 80, 171–182, 1985. (doi:10.1039/DC9858000171Link opens in a new window).
- [b — tildesley.dj:1985.a]
- Dominic J. Tildesley and Michael P. Allen. Error in CCP5 programs MDTETRA and MDPOLY. CCP5 Quarterly, 16, March 1985. (Available onlineLink opens in a new window).
1984
- [a — allen.mp:1984.a]
- Michael P. Allen. Atomic and molecular representations of molecular hydrodynamic variables. Molec. Phys., 52, 705–716, 1984. (doi:10.1080/00268978400101491Link opens in a new window).
- [b — allen.mp:1984.b]
- Michael P. Allen. A molecular dynamics simulation study of octopoles in the field of a planar surface. Molec. Phys., 52, 717–732, 1984. (doi:10.1080/00268978400101501Link opens in a new window).
- [c — allen.mp:1984.c]
- Michael P. Allen and Gisele Maréchal. Nonequilibrium molecular dynamics of molecules with bond length constraints. CCP5 Quarterly, 12, March 1984. (Available onlineLink opens in a new window).
- [d — allen.mp:1984.d]
- Michael P. Allen, Hans C. Andersen, André Bellemans, John Board, Julian H. R. Clarke, Mauro Ferrario, Jim M. Haile, Shuichi Nosé, J. V. Opheusden, and Jean-Paul Ryckaert. New molecular dynamics methods for various ensembles. Technical report, Rapport d'activité scientifique du CECAM, 1984.
1983
- [a — allen.mp:1983.a]
- Michael P. Allen, Daan Frenkel, William Gignac, and John P. McTague. A Monte Carlo simulation study of the two-dimensional melting mechanism. J. Chem. Phys., 78, 4206–4222, 1983. (doi:10.1063/1.445098Link opens in a new window).
1982
- [a — allen.mp:1982.a]
- Michael P. Allen. Algorithms for Brownian dynamics. Molec. Phys., 47, 599–601, 1982. (doi:10.1080/00268978200100432Link opens in a new window).
- [b — allen.mp:1982.b]
- Michael P. Allen. Quaternion parameter algorithms. CCP5 Quarterly, 5, June 1982. (Available onlineLink opens in a new window).
1981
- [a — chappell.pj:1981.a]
- Philip J. Chappell, Robert I. Hallem, Michael P. Allen, and Daniel Kivelson. Theory of depolarized light scattering. J. Chem. Phys., 74, 5929–5941, 1981. (doi:10.1063/1.441030Link opens in a new window).
- [b — allen.mp:1981.a]
- Michael P. Allen, Philip J. Chappell, and Daniel Kivelson. A three-variable theory of flow birefringence and its relation to depolarized light scattering. J. Chem. Phys., 74, 5942–5945, 1981. (doi:10.1063/1.441031Link opens in a new window).
- [c — kivelson.d:1981.a]
- Daniel Kivelson, Philip J. Chappell, and Michael P. Allen. A fruitful application of generalized hydrodynamics: depolarized light scattering. KINAM, 3, 57–70, 1981.
- [d — allen.mp:1981.b]
- Michael P. Allen and Daniel Kivelson. Nonequilibrium molecular dynamics simulation and the generalized hydrodynamics of transverse modes in molecular fluids. Molec. Phys., 44, 945–965, 1981. (doi:10.1080/00268978100102911Link opens in a new window).
1980
- [a — allen.mp:1980.a]
- Michael P. Allen and Peter Schofield. Molecular dynamics simulation of a chemical reaction in solution. Molec. Phys., 39, 207–215, 1980. (doi:10.1080/00268978000100171Link opens in a new window).
- [b — allen.mp:1980.b]
- Michael P. Allen. Brownian dynamics simulation of a chemical reaction in solution. Molec. Phys., 40, 1073–1087, 1980. (doi:10.1080/00268978000102141Link opens in a new window).