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Jayant  K. Singh
Jayant K. Singh
Chair Professor, Chemical Engineering, Indian Institute of Technology
Verified email at iitk.ac.in - Homepage
Title
Cited by
Cited by
Year
Vapor− Liquid Phase Coexistence, Critical Properties, and Surface Tension of Confined Alkanes
SK Singh, A Sinha, G Deo, JK Singh
The Journal of Physical Chemistry C 113 (17), 7170-7180, 2009
3822009
Appropriate methods to combine forward and reverse free-energy perturbation averages
N Lu, JK Singh, DA Kofke
The Journal of chemical physics 118, 2977, 2003
2312003
Mayer sampling: Calculation of cluster integrals using free-energy perturbation methods
JK Singh, DA Kofke
Physical review letters 92 (22), 220601, 2004
2232004
Recent advances in the carrier mobility of two-dimensional materials: a theoretical perspective
SH Mir, VK Yadav, JK Singh
ACS omega 5 (24), 14203-14211, 2020
2112020
Removal of heavy metal ions using a functionalized single-walled carbon nanotube: a molecular dynamics study
K Anitha, S Namsani, JK Singh
The Journal of Physical Chemistry A 119 (30), 8349-8358, 2015
1782015
Surface tension and vapor–liquid phase coexistence of the square-well fluid
JK Singh, DA Kofke, JR Errington
The Journal of chemical physics 119, 3405, 2003
1522003
Molecular simulation of shale gas adsorption and diffusion in inorganic nanopores
A Sharma, S Namsani, JK Singh
Molecular Simulation 41 (5-6), 414-422, 2015
1432015
Effect of pore morphology on vapor–liquid phase transition and crossover behavior of critical properties from 3D to 2D
SK Singh, JK Singh
Fluid Phase Equilibria 300 (1), 182-187, 2011
1252011
Higher-order virial coefficients of water models
KM Benjamin, JK Singh, AJ Schultz, DA Kofke
The Journal of Physical Chemistry B 111 (39), 11463-11473, 2007
1092007
Calculation of phase coexistence properties and surface tensions of n-alkanes with grand-canonical transition-matrix Monte Carlo simulation and finite-size scaling
JK Singh, JR Errington
The Journal of Physical Chemistry B 110 (3), 1369-1376, 2006
1032006
Phase transitions in nanoconfined fluids: The evidence from simulation and theory
PT Cummings, H Docherty, CR Iacovella, JK Singh
AIChE Journal 56 (4), 842-848, 2010
972010
Fabrication of durable superhydrophobic coatings on cotton fabrics with photocatalytic activity by fluorine-free chemical modification for dual-functional water purification
AK Singh, JK Singh
New Journal of Chemistry 41 (11), 4618-4628, 2017
952017
Effect of Different Surfactants on the Interfacial Behavior of the n-Hexane–Water System in the Presence of Silica Nanoparticles
NR Biswal, N Rangera, JK Singh
The Journal of Physical Chemistry B 120 (29), 7265-7274, 2016
932016
Vapor-liquid phase coexistence curves for Morse fluids
JK Singh, J Adhikari, SK Kwak
Fluid phase equilibria 248 (1), 1-6, 2006
912006
Wetting transition of water on graphite and boron-nitride surfaces: A molecular dynamics study
RC Dutta, S Khan, JK Singh
Fluid Phase Equilibria 302 (1-2), 310-315, 2011
862011
Wetting transition of nanodroplets of water on textured surfaces: a molecular dynamics study
S Khan, JK Singh
Molecular Simulation 40 (6), 458-468, 2014
842014
Surface tension and vapor-liquid phase coexistence of confined square-well fluid
JK Singh, SK Kwak
The Journal of chemical physics 126, 024702, 2007
842007
Fabrication of zirconia based durable superhydrophobic–superoleophilic fabrics using non fluorinated materials for oil–water separation and water purification
AK Singh, JK Singh
RSC advances 6 (105), 103632-103640, 2016
792016
Molecular modeling for the design of novel performance chemicals and materials
B Rai
CRC Press, 2012
752012
Understanding carbon dioxide adsorption in carbon nanotube arrays: molecular simulation and adsorption measurements
M Rahimi, JK Singh, DJ Babu, JJ Schneider, F Müller-Plathe
The Journal of Physical Chemistry C 117 (26), 13492-13501, 2013
702013
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