Surendra K. Jain, Ph.D.

Affiliations: 
2008 North Carolina State University, Raleigh, NC 
Area:
Chemical Engineering
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"Surendra Jain"

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Keith E. Gubbins grad student 2008 NCSU
 (Molecular modeling of microporous and templated mesoporous carbons.)
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Publications

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Peng X, Vicent-Luna JM, Jain SK, et al. (2019) Computational Study of the Effect of Functional Groups on Water Adsorption in Mesoporous Carbons: Implications for Gas Adsorption Acs Applied Nano Materials. 2: 7103-7113
Liu A, Jain SK, Jin Q, et al. (2018) Adsorption and structure of benzene confined in disordered porous carbons: effect of pore heterogeneity and surface chemistry Molecular Simulation. 44: 1291-1303
Peng X, Jain SK. (2018) Understanding the Influence of Pore Heterogeneity on Water Adsorption in Realistic Molecular Models of Activated Carbons The Journal of Physical Chemistry C. 122: 28702-28711
Jain SK, Pellenq RJ, Gubbins KE, et al. (2017) Molecular Modeling and Adsorption Properties of Ordered Silica Templated CMK Mesoporous Carbons. Langmuir : the Acs Journal of Surfaces and Colloids
Peng X, Jain SK. (2017) Atomic simulation of Xe and Kr separation in silica-templated amorphous mesoporous carbons CMK-3 and CMK-5 Molecular Simulation. 43: 1546-1555
Peng X, Jain SK, Singh JK. (2017) Adsorption and Separation of N2/CH4/CO2/SO2 Gases in Disordered Carbons Obtained Using Hybrid Reverse Monte Carlo Simulations The Journal of Physical Chemistry C. 121: 13457-13473
Halder P, Maurya M, Jain SK, et al. (2016) Understanding adsorption of CO2, N2, CH4 and their mixtures in functionalized carbon nanopipe arrays. Physical Chemistry Chemical Physics : Pccp
MISRA RK, JAIN SK, ABRAHAM TN, et al. (2011) AMIDE FUNCTIONALIZATION OF MULTIWALLED CARBON NANOTUBES AND THEIR EVALUATION FOR Hg(II) REMOVAL FROM WATER International Journal of Nanoscience. 10: 205-208
Lísal M, Cosoli P, Smith WR, et al. (2008) Molecular-level simulations of chemical reaction equilibrium for nitric oxide dimerization reaction in disordered nanoporous carbons Fluid Phase Equilibria. 272: 18-31
Jain SK, Gubbins KE. (2007) Ring connectivity: measuring network connectivity in network covalent solids. Langmuir : the Acs Journal of Surfaces and Colloids. 23: 1123-30
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