64 Articles in Refereed Journals   2011-2010-2009-2008-2007-2006-2005-2004-2003-2002-2001-2000-1999
         6 Editorials

                                                                                              2011

	J. Persson, C. Desgranges and J. Delhommelle, Chem. Phys. Lett. 511, 57 (2011) Polymorph Selection during the Crystallization of Iron under the Conditions of Earth's Inner Core.
	J. Delhommelle,  Molec. Simul. 37, 613 (2011) Crystal nucleation and growth from supercooled melts.
	C. Desgranges and J. Delhommelle, J. Am. Chem. Soc. 133, 2872 (2011) Role of Liquid Polymorphism during the Crystallization of Silicon.
	K. D. Watson, S. E. Tatsinkou Nguelo, C. Desgranges and J. Delhommelle, CrystEngComm 13, 1132 (2011)  Crystal nucleation and growth in Pd-Ni alloys: a molecular simulation study.

	C. Desgranges, E. A. Kastl, T. Aleksandrov and J. Delhommelle, Molec. Simul. 36, 544 (2010) Optimization of Multiple Time Step Hybrid Monte Carlo Wang-Landau simulations in the isobaric-isothermal ensemble for the determination of phase equilibria.
	C. Desgranges, J. M. Hicks, A. Magness and J. Delhommelle, Mol. Phys. 108, 151 (2010) Phase equilibria of polyaromatic hydrocarbons by Hybrid Monte Carlo Wang-Landau simulations.
	T. Aleksandrov, C. Desgranges and J. Delhommelle, Fluid Phase Equilibria 287, 79 (2010) Vapor-liquid equilibria of Copper using  hybrid Monte Carlo Wang-Landau Simulations.

	K. Ndumbe Ngale, C. Desgranges and J. Delhommelle, J. Chem. Phys. 131, 244515 (2009) Nucleation and growth of C60 nanoparticles from the supersaturated vapor and from the undercooled liquid: A molecular simulation study.
	C. Desgranges and J. Delhommelle, J. Chem. Phys. 130, 244109 (2009) Phase equilibria of molecular fluids via hybrid Monte Carlo Wang-Landau simulations: Applications to benzene and n-alkanes.
	C. Desgranges and J. Delhommelle, Phys. Rev. E 79, 052201 (2009) Universal scaling law for energy and pressure in a shearing fluid
	C. Desgranges and J. Delhommelle, Molec. Simul. 35, 405 (2009)  Accurate determination of normal stress differences via transient-time correlation function - non-equilibrium molecular dynamics (TTCF-NEMD) simulations
	C. Desgranges and J. Delhommelle, J. Phys. Chem. C 113, 3607 (2009)  Molecular Simulation of the Nucleation and Growth of Gold Nanoparticles.

	C. Desgranges and J. Delhommelle, Phys. Rev. B 78, 184202 (2008) Rheology of liquid fcc metals: equilibrium and transient-time correlation function nonequilibrium molecular dynamics simulations.
	C. Desgranges and J. Delhommelle, Molec. Simul. 34, 177 (2008) Estimating the conductivity of a nanoconfined liquid subjected to an experimentally accessible external field.
	C. Desgranges and J. Delhommelle, Phys. Rev. E 77, 027701 (2008) Molecular Simulation of Transport in Nanopores: Application of the Transient-Time Correlation Function Formalism.
	C. Desgranges and J. Delhommelle, Phys. Rev. B 77, 054201 (2008) Crystallization Mechanisms for Xenon at high Pressure and high Temperature.
	C. Desgranges and J. Delhommelle, J. Chem. Phys. 128, 084506 (2008) Shear Viscosity of Liquid Copper at experimentally accessible Shear Rates: Application of the Transient-Time Correlation Function Formalism.

	C. Desgranges and J. Delhommelle, Phys. Rev. B 76, 172102 (2007) Viscosity of Liquid Iron under High Pressure and High Temperature: Equilibrium and Nonequilibrium Molecular Dynamics Simulation Studies.
	C. Desgranges and J. Delhommelle, J. Phys. Chem. B 111, 12257 (2007) Polymorph Selection during the Crystallization of Softly-Repulsive Spheres: The Inverse Power Law Potential.
	C. Desgranges and J. Delhommelle, J. Chem. Phys. 127, 144509 (2007) Molecular Simulation of the Crystallization of Aluminum from the supercooled Liquid.
	J.-M. Bomont, J. Delhommelle and J.-L. Bretonnet, J. Non-Cryst. Solids 353, 3454 (2007) Structure and Thermodynamics of the expanded Liquid Mercury by Monte Carlo simulation: A first Attempt.
	J.-M. Leyssale, J. Delhommelle and C. Millot, J. Chem. Phys. 127, 044504 (2007) Hit and Miss of Classical Nucleation Theory as revealed by a molecular dynamics Study of Crystal Nucleation in Supercooled Sulfur Hexafluoride.
	C. Desgranges and J. Delhommelle, J. Am. Chem. Soc. 129, 7012 (2007) Molecular Insight into the Pathway to Crystallization of Aluminum.
	C. Desgranges and J. Delhommelle, Phys. Rev. Lett. 98, 235502 (2007) Controlling Polymorph Selection during the Crystallization of an Atomic Fluid.
	C. Desgranges and J. Delhommelle, J. Phys. Chem. B 111, 1465 (2007) Molecular Simulation of Cross-Nucleation between Polymorphs.
	C. Desgranges and J. Delhommelle, J. Chem. Phys. 126, 054501 (2007) Polymorph Selection during the Crystallization of Yukawa systems.

	C. Desgranges and J. Delhommelle, J. Am. Chem. Soc. 128, 15104 (2006) Insights into the Molecular Mechanism underlying Polymorph Selection.
	C. Desgranges and J. Delhommelle, J. Am. Chem. Soc. 128, 10368 (2006) Molecular Mechanism for the Cross-Nucleation between Polymorphs.

	J. Delhommelle and P. T. Cummings, Phys. Rev. B 72, 172201 (2005) Simulation of friction in nanoconfined fluids for an arbitrarily low shear rate.
	J. Delhommelle, P. T. Cummings and J. Petravic, J. Chem. Phys. 123, 114505 (2005) Conductivity of molten sodium chloride in an arbitrarily weak dc electric field.
	J. Delhommelle and J. Petravic, J. Chem. Phys. 123, 074707 (2005) Shear-thickening in a model colloidal suspension.
	J. Petravic and J. Delhommelle, J. Chem. Phys. 122, 234509 (2005) Hydrogen bonding in ethanol under shear. Also featured in the Virtual Journal of Biological Physics Research (Volume 10, Issue 1).
	J.-M. Leyssale, J. Delhommelle and C. Millot, J. Chem. Phys. 122, 184518 (2005) Molecular simulation of the homogeneous crystal nucleation of carbon dioxide.
	J.-M. Leyssale, J. Delhommelle and C. Millot, J. Chem. Phys. 122, 104510 (2005) Atomistic simulation of the homogeneous nucleation and of the growth of N2 crystallites.
	J. Delhommelle, Phys. Rev. E 71, 016705 (2005) Should “lane formation” occur systematically in driven liquids and colloids?

	J.-M. Leyssale, J. Delhommelle and C. Millot, J. Am. Chem. Soc. 126, 12286 (2004) Reorganization and growth of metastable α-N2 critical nuclei into stable β-N2 crystals.
	J. Delhommelle, Eur. Phys. J. E 15, 65 (2004) Onset of shear-thickening in simple fluids.
	J. Petravic and J. Delhommelle, Int. J. Thermophys. 25, 1375 (2004) Nonequilibrium molecular dynamics simulations of molten sodium chloride.
	J. Delhommelle, Phys. Rev. B 69, 144117 (2004) Simulations of shear-induced melting in two dimensions.
	J. Delhommelle, J. Petravic and D. J. Evans, J. Chem. Phys. 120, 6117 (2004) Non-Newtonian behavior in simple fluids.

	J. Delhommelle, J. Petravic and D. J. Evans, J. Chem. Phys. 119, 11005 (2003) On the effects of assuming the flow profile in nonequilibrium simulations.
	J. Petravic and J. Delhommelle, J. Chem. Phys. 119, 8511 (2003) Conductivity of molten sodium chloride in an alternating electric field.
	J. Delhommelle, J. Petravic and D. J. Evans, Phys. Rev. E 68, 031201 (2003) Reexamination of string phase and shear thickening in simple fluids.
	J.-M. Leyssale, J. Delhommelle and C. Millot, Chem. Phys. Lett. 375, 612 (2003) A molecular dynamics study of homogeneous crystal nucleation in liquid nitrogen.
	J. Petravic and J. Delhommelle,  J. Chem. Phys. 118, 7477 (2003) Conductivity of molten sodium chloride and its supercritical vapor in strong dc fields
	J. Delhommelle and J. Petravic, J. Chem. Phys. 118, 2783 (2003) Shear viscosity of molten sodium chloride
	J. Petravic and J. Delhommelle, Chem. Phys. 286, 303 (2003) Influence of temperature, pressure and internal degrees of freedom on hydrogen bonding and diffusion on liquid ethanol

	J. Delhommelle, Mol. Phys. 100, 3479 (2002) Rotational viscosity of uniaxial molecules
	J. Delhommelle and D. J. Evans, J. Chem. Phys. 117, 6016 (2002) Correspondence between configurational temperature and molecular kinetic temperature thermostats
	J. Delhommelle and D. J. Evans, Mol. Phys. 100, 2857 (2002) Poiseuille flow for micropolar fluids
	L. Lue, O. G. Jepps, J. Delhommelle and D. J. Evans, Mol. Phys. 100, 2387 (2002) Configuration thermostats for molecular systems

	J. Delhommelle and D. J. Evans, Mol. Phys. 99, 1825 (2001) Configurational temperature thermostat for fluids undergoing shear flow: application to liquid chlorine
	J. Delhommelle and D. J. Evans, J. Chem. Phys. 115, 43 (2001) Comparison of thermostatting mechanisms in NVT and NPT simulations of decane under shear
	J. Delhommelle and P. Millie, Mol. Phys. 99, 619 (2001) Inadequacy of the Lorentz-Berthelot combining rules for accurate predictions of equilibrium properties by molecular simulation
	J. Delhommelle and D. J. Evans, J. Chem. Phys. 114, 6236 (2001) Configurational temperature profile in confined fluids. II. Molecular fluids
	J. Delhommelle and D. J. Evans, J. Chem. Phys. 114, 6229 (2001) Configurational temperature profile in confined fluids. I. Atomic fluid

	J. Delhommelle, P. Millie, and A. H. Fuchs, Mol. Phys. 98, 1895 (2000) On the role of the definition of potential models in Gibbs ensemble phase equilibria simulations of the H2S-pentane mixture
	J. Delhommelle, C. Tschirwitz, P. Ungerer, G. Granucci, P. Millie, D. Pattou, and A. H. Fuchs, J. Phys. Chem. B 104, 4745 (2000) Derivation of an Optimized Potential for Phase Equilibria (OPPE) for sulfides and thiols
	P. Ungerer, C. Beauvais, J. Delhommelle, A. Boutin, B. Rousseau, and A. H. Fuchs, J. Chem. Phys. 112, 5499 (2000) Optimization of the anisotropic united atoms intermolecular potential for n-alkanes

	J. Delhommelle, A. Boutin, and A. H. Fuchs, Molec. Simul. 22, 351 (1999) Molecular Simulation of vapour-liquid coexistence curves for hydrogen sulfide-alkane and carbon dioxide-alkane mixturesEditoril
	J. Delhommelle, G. Granucci, V. Brenner, P. Millie, A. Boutin, and A. H. Fuchs, Mol. Phys. 96, 1517 (1999) A new method for deriving atomic charges and dipoles for n-alkanes : investigation of transferability and geometry dependence
	B. Neubauer, J. Delhommelle, A. Boutin, B. Tavitian, and A. H. Fuchs, Fluid Phase Equilibria 115, 167 (1999) Monte Carlo simulations of squalane in the Gibbs ensemble
	J. Delhommelle, A. Boutin, B. Tavitian, A. D. Mackie, and A. H. Fuchs, Mol. Phys. 96, 1517 (1999) Vapour-liquid coexistence curves of the united-atom and anisotropic united-atom force fields for alkane mixtures

            Editorials

	J. Delhommelle, Molec. Simul. 37, 515 (2011) Guest Editorial: Recent Advances in Molecular Simulation.
	J. Delhommelle, Molec. Simul. 36, 497 (2010) Guest Editorial: Recent Developments in Molecular Simulations.
	J. Delhommelle, Molec. Simul. 35, 771 (2009) Guest Editorial: Frontiers of Molecular Simulation.
	J. Delhommelle, Molec. Simul. 34, 117 (2008) Guest Editorial: Recent Advances in Molecular Simulation.
	J. Delhommelle, Molec. Simul. 33, 711 (2007) Guest Editorial: Recent Developments in Molecular Simulation.
	J. Delhommelle, Molec. Simul. 32, 173 (2006) Guest Editorial: Frontiers of Molecular Simulation.