Pablo G Debenedetti

发表

Mathematical modeling of high temperature fuel cells

Pablo G Debenedetti, 1981 .

Family of tunable spherically symmetric potentials that span the range from hard spheres to waterlike behavior.

Zhenyu Yan, H Eugene Stanley, Sergey V Buldyrev, 2006, Physical review. E, Statistical, nonlinear, and soft matter physics.

Integrating diffusion maps with umbrella sampling: application to alanine dipeptide.

Ioannis G Kevrekidis, Andrew L. Ferguson, Andrew L Ferguson, 2011, The Journal of chemical physics.

Structure of the first- and second-neighbor shells of simulated water: quantitative relation to translational and orientational order.

Zhenyu Yan, H Eugene Stanley, Sergey V Buldyrev, 2007, Physical review. E, Statistical, nonlinear, and soft matter physics.

Computational characterization of the sequence landscape in simple protein alphabets

Athanassios Z Panagiotopoulos, M Scott Shell, Pablo G Debenedetti, 2006, Proteins.

Finite-size scaling study of the vapor-liquid critical properties of confined fluids: Crossover from three dimensions to two dimensions.

Yang Liu, Athanassios Z Panagiotopoulos, Pablo G Debenedetti, 2010, The Journal of chemical physics.

Generalization of the Wang-Landau method for off-lattice simulations.

Athanassios Z Panagiotopoulos, M Scott Shell, Pablo G Debenedetti, 2002, Physical review. E, Statistical, nonlinear, and soft matter physics.

Homogeneous Nucleation of Methane Hydrate in Microsecond Molecular Dynamics Simulations.

Sapna Sarupria, Pablo G Debenedetti, P. Debenedetti, 2012, The journal of physical chemistry letters.

Effect of pressure on the phase behavior and structure of water confined between nanoscale hydrophobic and hydrophilic plates.

Pablo G Debenedetti, Peter J Rossky, P. Rossky, 2006, Physical review. E, Statistical, nonlinear, and soft matter physics.

Direct calculation of ice homogeneous nucleation rate for a molecular model of water

Pablo G Debenedetti, P. Debenedetti, A. Haji-Akbari, 2015, Proceedings of the National Academy of Sciences.

Free energy barriers to evaporation of water in hydrophobic confinement.

Pablo G Debenedetti, Sumit Sharma, P. Debenedetti, 2012, The journal of physical chemistry. B.

Cooperative origin of low-density domains in liquid water.

Salvatore Torquato, Jeffrey R Errington, Pablo G Debenedetti, 2002, Physical review letters.

Liquid-liquid transition in ST2 water.

Yang Liu, Athanassios Z Panagiotopoulos, Pablo G Debenedetti, 2012, The Journal of chemical physics.

Lindemann measures for the solid-liquid phase transition.

Charusita Chakravarty, Pablo G Debenedetti, Frank H Stillinger, 2007, The Journal of chemical physics.

Comment on "The putative liquid-liquid transition is a liquid-solid transition in atomistic models of water" [I and II: J. Chem. Phys. 135, 134503 (2011); J. Chem. Phys. 138, 214504 (2013)].

Roberto Car, Athanassios Z Panagiotopoulos, Pablo G Debenedetti, 2018, The Journal of chemical physics.

An experimental and computational investigation of spontaneous lasso formation in microcin J25.

Andrew L. Ferguson, Andrew L Ferguson, Siyan Zhang, 2010, Biophysical journal.

Solubility and molecular conformations of n-alkane chains in water.

Andrew L. Ferguson, Andrew L Ferguson, Athanassios Z Panagiotopoulos, 2009, The journal of physical chemistry. B.

Phase transitions induced by nanoconfinement in liquid water.

Pablo G Debenedetti, Peter J Rossky, P. Rossky, 2009, Physical review letters.

Molecular structural order and anomalies in liquid silica.

Athanassios Z Panagiotopoulos, M Scott Shell, Pablo G Debenedetti, 2002, Physical review. E, Statistical, nonlinear, and soft matter physics.

Computational investigation of surface freezing in a molecular model of water

Pablo G Debenedetti, P. Debenedetti, A. Haji-Akbari, 2017, Proceedings of the National Academy of Sciences.

Structural order in glassy water.

H Eugene Stanley, Francesco Sciortino, Pablo G Debenedetti, 2005, Physical review. E, Statistical, nonlinear, and soft matter physics.

Molecular dynamics study of carbon dioxide hydrate dissociation.

Sapna Sarupria, Pablo G Debenedetti, P. Debenedetti, 2011, The journal of physical chemistry. A.

A computational investigation of thermodynamics, structure, dynamics and solvation behavior in modified water models.

Pablo G Debenedetti, Frank H Stillinger, F. Stillinger, 2008, The Journal of chemical physics.

Effect of surface polarity on water contact angle and interfacial hydration structure.

Pablo G Debenedetti, Peter J Rossky, P. Rossky, 2007, The journal of physical chemistry. B.