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Jeffrey R Errington
Jeffrey R Errington
Professor in Chemical and Biological Engineering, University at Buffalo
Email confirmado em buffalo.edu - Página inicial
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Relationship between structural order and the anomalies of liquid water
JR Errington, PG Debenedetti
Nature 409 (6818), 318-321, 2001
14792001
Direct calculation of liquid–vapor phase equilibria from transition matrix Monte Carlo simulation
JR Errington
The Journal of chemical physics 118 (22), 9915-9925, 2003
3362003
A new intermolecular potential model for the n-alkane homologous series
JR Errington, AZ Panagiotopoulos
The Journal of Physical Chemistry B 103 (30), 6314-6322, 1999
2271999
A fixed point charge model for water optimized to the vapor− liquid coexistence properties
JR Errington, AZ Panagiotopoulos
The Journal of Physical Chemistry B 102 (38), 7470-7475, 1998
2161998
A computational study of hydration, solution structure, and dynamics in dilute carbohydrate solutions
SL Lee, PG Debenedetti, JR Errington
The Journal of chemical physics 122 (20), 204511, 2005
2052005
Evaluating surface tension using grand-canonical transition-matrix Monte Carlo simulation and finite-size scaling
JR Errington
Physical Review E 67 (1), 012102, 2003
1942003
Layering and position-dependent diffusive dynamics of confined fluids
J Mittal, TM Truskett, JR Errington, G Hummer
Physical review letters 100 (14), 145901, 2008
1902008
Molecular simulation of phase equilibria for mixtures of polar and non-polar components
JJ Potoff, JR Errington, AZ Panagiotopoulos
Molecular Physics 97 (10), 1073-1083, 1999
1871999
Excess-entropy-based anomalies for a waterlike fluid
JR Errington, TM Truskett, J Mittal
The Journal of chemical physics 125 (24), 244502, 2006
1822006
Thermodynamics predicts how confinement modifies the dynamics of the equilibrium hard-sphere fluid
J Mittal, JR Errington, TM Truskett
Physical review letters 96 (17), 177804, 2006
1592006
Quantification of order in the Lennard-Jones system
JR Errington, PG Debenedetti, S Torquato
The Journal of chemical physics 118 (5), 2256-2263, 2003
1552003
Phase equilibria of the modified Buckingham exponential-6 potential from Hamiltonian scaling grand canonical Monte Carlo
JR Errington, AZ Panagiotopoulos
The Journal of chemical physics 109 (3), 1093-1100, 1998
1521998
New intermolecular potential models for benzene and cyclohexane
JR Errington, AZ Panagiotopoulos
The Journal of chemical physics 111 (21), 9731-9738, 1999
1461999
Nucleation and cavitation of spherical, cylindrical, and slablike droplets and bubbles in small systems
LG MacDowell, VK Shen, JR Errington
The Journal of chemical physics 125 (3), 034705, 2006
1442006
Surface tension and vapor–liquid phase coexistence of the square-well fluid
JK Singh, DA Kofke, JR Errington
The Journal of chemical physics 119 (6), 3405-3412, 2003
1432003
Molecular simulation of phase equilibria for water− methane and water− ethane mixtures
JR Errington, GC Boulougouris, IG Economou, AZ Panagiotopoulos, ...
The Journal of Physical Chemistry B 102 (44), 8865-8873, 1998
1391998
Cooperative origin of low-density domains in liquid water
JR Errington, PG Debenedetti, S Torquato
Physical review letters 89 (21), 215503, 2002
1362002
Relationship between thermodynamics and dynamics of supercooled liquids
J Mittal, JR Errington, TM Truskett
The Journal of chemical physics 125 (7), 076102, 2006
1272006
Calculation of surface tension via area sampling
JR Errington, DA Kofke
The Journal of chemical physics 127 (17), 174709, 2007
1262007
Quantitative link between single-particle dynamics and static structure of supercooled liquids
J Mittal, JR Errington, TM Truskett
The Journal of Physical Chemistry B 110 (37), 18147-18150, 2006
1192006
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