Publications

2012 2011 2010 2009 2008 2007 2006 2005 2004 2003
2002 2001 2000 1999 1998 1997 1996 1995 1994

Contribution to Books

  1. Kevin Van Workum, Thomas R. Böhme, and Juan J. de Pablo.
    "Modelling of Polymer Glasses: Molecular Dynamics".
    Encyclopedia of Materials: Science and Technology, Elsevier, 2004 November 10. ISBN 0-08-043152-6. [DOI]

Refereed Journals

  1. L. de Pablo, M. L. Chávez, Amadeu K. Sum, and Juan J. de Pablo.
    "Monte Carlo molecular simulation of the hydration of Na-montmorillonite at reservoir conditions".
    Journal of Chemical Physics 120(2):939--946, January 8, 2004. [doi:10.1063/1.1631440] [AIP/JCP]
  2. Satoshi Ohtake, Carolina Schebor, Sean P. Palecek, and Juan J. de Pablo.
    "Effect of sugar-phosphate mixtures on the stability of DPPC membranes in dehydrated systems".
    Cryobiology 48(1):81-89, 2004 February. [DOI]
  3. Richard M. Jendrejack, David C. Schwartz, Juan J. de Pablo, and Michael D. Graham.
    "Shear-induced migration in flowing polymer solutions: Simulation of long-chain DNA in microchannels".
    Journal of Chemical Physics 120(5):2513-2529, 2004 February 1. [DOI] [AIP/JCP]
    Publisher's note: Journal of Chemical Physics 120(13):6315, 2004 April 1. [DOI] [AIP/JCP]
  4. Nitin Rathore, Qiliang Yan, and Juan J. de Pablo.
    "Molecular simulation of the reversible mechanical unfolding of proteins".
    Journal of Chemical Physics 120(12):5781-5788, 2004 March 22. [DOI] [AIP/JCP]
  5. Tushar S. Jain and Juan J. de Pablo.
    "Investigation of transition states in bulk and free-standing film polymer glasses".
    Physical Review Letters, 92(15):155505, 2004 April 16. [DOI] [APS/PRL]
  6. Manolis Doxastakis, Yeng-Long Chen, Orlando Guzmán, and Juan J. de Pablo.
    "Polymer-particle mixtures: depletion and packing effects".
    Journal of Chemical Physics 120(19):9335-9342, 2004 May 15. [doi:10.1063/1.1704634] [AIP/JCP]
  7. Tushar S. Jain and Juan J. de Pablo.
    "Influence of confinement on the vibrational density of states and the Boson peak in a polymer glass ".
    Journal of Chemical Physics 120(19):9371-9375, 2004 May 15. [DOI] [AIP/JCP]
  8. Evelina B. Kim and Juan J. de Pablo.
    "Potential of mean force between a spherical particle suspended in a nematic liquid crystal and a substrate: Sphere size effects".
    Physical Review E 69(6 Pt 1):061703, 2004 June 2. [DOI] [APS/PRE]
  9. Rajesh Khare, Amadeu K. Sum, Shyamal K. Nath, and Juan J. de Pablo.
    "Simulation of Vapor-Liquid Phase Equilibria of Primary Alcohols and Alcohol-Alkane Mixtures".
    Journal of Physical Chemistry B 108(28) 10071--10076, June 10, 2004. [doi:10.1021/jp048144d] [ACS]
  10. Qiliang Yan, Tushar S. Jain, and Juan J. de Pablo.
    "Density-of-States Monte Carlo Simulation of a Binary Glass".
    Physical Review Letters, 92(23):235701, June 11, 2004. [doi:10.1103/PhysRevLett.92.235701] [APS/PRL]
  11. Brian J. Banaszak, Roland Faller, and Juan J. de Pablo.
    "Simulation of the effects of chain architecture on the sorption of ethylene in polyethylene".
    Journal of Chemical Physics 120(23):11304-11315, 2004 June 15. [DOI] [AIP/JCP]
  12. Evelina B. Kim, Orlando Guzmán, Sylvain Grollau, Nicholas L. Abbott, and Juan J. de Pablo.
    "Interactions between spherical colloids mediated by a liquid crystal: a molecular simulation and mesoscale study".
    Journal of Chemical Physics 121(4):1949-1961, 2004 July 22. [DOI] [AIP/JCP]
  13. Kenji Yoshimoto, Mark P. Stoykovich, Heidi B. Cao, Juan J. de Pablo, Paul F. Nealey, and Walter J. Drugan.
    "A two-dimensional model of the deformation of photoresist structures using elastoplastic polymer properties".
    Journal of Applied Physics, 96(4):1857-1865, 2004 August 15. [DOI] [AIP/JAP]
  14. Satoshi Ohtake, Carolina Schebor, Sean P. Palecek, and Juan J. de Pablo.
    "Effect of pH, counter ion, and phosphate concentration on the glass transition temperature of freeze-dried sugar-phosphate mixtures".
    Pharmaceutical Research 21(9) 1615-1621, 2004 September. [Springer]
  15. Eileen T. Dimalanta, Alex Lim, Rod Runnheim, Casey Lamers, Chris Churas, Daniel K. Forrest, Juan J. de Pablo, Michael D. Graham, Susan N. Coppersmith, Steve Goldstein, and David C. Schwartz.
    "A microfluidic system for large DNA molecule arrays".
    Analytical Chemistry 76(18):5293-5301, 2004 September 15. [DOI]
  16. Kenji Yoshimoto, Tushar S. Jain, Kevin Van Workum, Paul F. Nealey, Juan J. de Pablo.
    "Mechanical heterogeneities in model polymer glasses at small length scales".
    Physical Review Letters, 93(17):175501, October 18, 2004. [doi:10.1103/PhysRevLett.93.175501] [APS/PRL]
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  18. M. de Lourde Chávez-García, Liberto de Pablo-Galán, and Juan J. de Pablo.
    "Monte Carlo Molecular Simulation of the Hydration of K-Montmorillonite at 353 K and 625 bar".
    Langmuir 20(24) 10764-10770, 2004 October 27. [DOI]
  19. Yeng-Long Chen, Michael D. Graham, Juan J. de Pablo, Greg C. Randall, Malancha Gupta, and Patrick S. Doyle.
    "Conformation and dynamics of single DNA molecules in parallel-plate slit microchannels".
    Physical Review E 70(6 Pt 1):060901®, 2004 December 13. [doi:10.1103/PhysRevE.70.060901] [APS/PRE]