Faculty

Ernest J and Barbara M Henley Associate Professor
Education:
Courses:
CHEE 3321 Analytical Methods (Fall 2014)
CHEE 3333 Chemical Engineering Thermodynamics (Fall 2015)
Research Interests:
Content coming soon
Awards & Honors:
Regional Blavatnik Award for Young Scientists (in Chemistry), 2014
NSF East Asia and Pacific Summer Institute Fellow (Japan), 2008
Selected Publications
-
Chen, R. J., et al,
"Influence of polymer flexibility on nanoparticle dynamics in semidilute solutions." Soft Matter 15(6): 1260-1268.
, 2019 -
Howard, M. P., et al. ,
"Modeling hydrodynamic interactions in soft materials with multiparticle collision dynamics." Current Opinion in Chemical Engineering 23: 34-43.
, 2019 -
Kim, S. B., Palmer, J. C., & Debenedetti, P. G.,
"Computational investigation of cold denaturation in the Trp-cage miniprotein", Proceedings of the National Academy of Sciences of the United States of America, 113(32), 8991-8996 [DOI]
, 2016 -
Palmer, J. C., Martelli, F., Liu, Y., Car, R., Panagiotopoulos, A. Z., & Debenedetti, P. G.,
"Metastability and no criticality Reply", Nature, 531(7593), E2-E3.
, 2016 -
Palmer, J. C., Singh, R. S., Chen, R. J., Martelli, F., & Debenedetti, P. G.,
Density and bond-orientational relaxations in supercooled water. Molecular Physics, 114(18), 2580-2585 [DOI]
, 2016 -
J. C. Palmer and P. G. Debenedetti,
“Recent Advances in Molecular Simulation: A Chemical Engineering Perspective,” AIChE Journal, 61, 370-383 [DOI]
, 2015 -
S. B. Kim, J. C. Palmer and P. G. Debenedetti,
“A Computational Study of the Effect of Matrix Structural Order on Water Sorption by Trp-Cage Miniproteins,” Journal of Physical Chemistry B, 119, 1847-185 [DOI]
, 2015 -
J. C. Palmer, F. Martelli, Y. Liu, R. Car, A. Z. Panagiotopoulos and P. G. Debenedetti,
“Metastable Liquid-Liquid Transition in a Molecular Model of Water,” Nature, 510, 385-388 [DOI]
, 2014 -
V. Holten, J. C. Palmer, P. H. Poole. P. G. Debenedetti and M. A. Anisimov,
“Two-State Thermodynamic Model of the ST2 Model for Supercooled Water,” Journal of Chemical Physics, 140, 104502 [DOI]
, 2014 -
J. C. Palmer, R. Car and P. G. Debenedetti,
“The Liquid-Liquid Transition in Supercooled ST2 Water: A Comparison Between Umbrella Sampling and Well-Tempered Metadynamics,” Faraday Discussion, 167, 77-94 [DOI]
, 2013 -
S. O. Diallo, M. Jażdżewska, J. C. Palmer, E. Mamontov, K. E. Gubbins and M. Śliwińska-Bartkowiak,
“Dynamics of Nanoconfined Water Under Pressure,” Physical Review E, 88, 022316 [DOI]
, 2013 -
Y. Long, J. C. Palmer, B. Coasne, M. M Śliwinska-Bartkowiak, G. Jackson, E. A. Müller and K. E. Gubbins,
“On the Molecular Origin of High-Pressure Effects in Nanoconfinement: The Role of Surface Chemistry and Roughness,” Journal of Chemical Physics, 139, 144701[DOI]
, 2013 -
J. C. Palmer and K. E. Gubbins,
“Atomistic Models for Disordered Nanoporous Carbons Using Reactive Force Fields,” Microporous and Mesoporous Materials, 154, 24-37 [DOI]
, 2012 -
J. C. Palmer and P. G. Debenedetti,
“Computer Simulation of Water Sorption on Flexible Protein Crystals,” Journal of Physical Chemistry Letters, 3, 2713-2718 [DOI]
, 2012 -
K. A. Phillips, J. C. Palmer and K. E. Gubbins,
“Analysis of the Solvation Structure of Rubidium Bromide under Nanoconfinement,” Molecular Simulation, 38, 1209-1220 [DOI]
, 2012 -
M. Sliwinska-Bartkowiak, H. Drozdowski, M. Kempinski, M. Jazdzewska, Y. Long, J. C. Palmer, and K. E. Gubbins,
“Structural Analysis of Water and Carbon Tetrachloride Adsorbed in Activated Carbon Fibres,” Physical Chemistry Chemical Physics, 14, 7145-7153 [DOI]
, 2012 -
Y. Liu, J. C. Palmer, A. Z. Panagiotopoulos and P. G. Debenedetti,
“Liquid-Liquid Transition in ST2 Water,” Journal of Chemical Physics, 137, 214505 [DOI]
, 2012 -
Y. Long, J. C. Palmer, B. Coasne, M. Sliwinska-Bartkowiak and K. E. Gubbins,
“Under Pressure: Quasi-High Pressure Effects in Nanopores,” Microporous and Mesoporous Materials, 154, 19-23 [DOI]
, 2012 -
Y. Long, M. Śliwińska-Bartkowiak, H. Drozdowski, M. Kempiński, K. A. Phillips, J. C Palmer and K. E. Gubbins,
“High Pressure Effect In Nanoporous Carbon Materials: Effects of Pore Geometry,” Colloids and Surfaces A, 437, 33-41 [DOI]
, 2012 -
J. C. Palmer, J. D. Moore, J. K. Brennan and K. E. Gubbins,
“Simulating Local Adsorption Isotherms in Models of Complex Porous Materials: A Direct Assessment of the Slit Pore Model,” Journal of Physical Chemistry Letters, 2, 165-169 [DOI]
, 2011 -
J. C. Palmer, J. D. Moore, J. K. Brennan and K. E. Gubbins,
“Adsorption and Diffusion of Argon in Disordered Nanoporous Carbons,” Adsorption, 17, 189-199 [DOI]
, 2011 -
J. C. Palmer, J. D. Moore, T. J. Roussel, J. K. Brennan and K. E. Gubbins,
“Adsorptive Behavior of CO2, CH4 and Their Mixtures in Carbon Nanospace: A Molecular Simulation Study,” Physical Chemistry Chemical Physics, 13, 3985-3996 [DOI]
, 2011 -
K. E. Gubbins, Y-C Liu, J. D. Moore and J. C. Palmer,
“The Role of Molecular Modeling in Confined Systems: Impacts and Prospects,” Physical Chemistry Chemical Physics, 13, 58-85 [DOI]
, 2011 -
Y. Long, J. C. Palmer, B. Coasne, M. Sliwinska-Bartkowiak and K. E. Gubbins,
“Pressure Enhancement in Nanopores: A Major Confinement Effect,” Physical Chemistry Chemical Physics, 13, 17163-17170 [DOI]
, 2011 -
J. C. Palmer, A. Llobet, S-H Yeon, J. E. Fischer, Y. Shi, Y. Gogotsi and K. E. Gubbins,
“Modeling the Structural Evolution of Carbide-Derived Carbons Using Quenched Molecular Dynamics,” Carbon, 48, 1116-1123 [DOI]
, 2010 -
J. D. Moore, J. C. Palmer, Y-C Liu, T. J. Roussel, J. K. Brennan and K. E. Gubbins,
“Adsorption and Diffusion of Argon Confined in Ordered and Disordered Microporous Carbons,” Applied Surface Science, 256, pp. 5131-5136 [DOI]
, 2010 -
J. C. Palmer, J. K. Brennan, M. M. Hurley, A. Balboa and K. E. Gubbins,
“Detailed Structural Models for Activated Carbons from Molecular Simulation,” Carbon, 47, 2904-2913 [DOI]
, 2009 -
J. C. Palmer, S. K. Jain, K. E. Gubbins, J. E. Fischer, R. Dash and Y. Gogotsi,
“Hybrid Reverse Monte Carlo Simulations of Microporous Carbons,”, In: S. Kaskel, P. Llewellyn, F. Rodriguez-Reinoso and N. Seaton, eds., Characterization of Porous Solids VIII: Proceedings of the 8th International Symposium on the Characterization of Porous Solids, Cambridge: RSC, 56-63
, 2008