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Sandip Khan
Sandip Khan
Assistant Professor, Department of Chemical and Biochemical Engineering, IIT Patna
Verified email at iitp.ac.in
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Cited by
Year
Cassandra: An open source Monte Carlo package for molecular simulation
JK Shah, E Marin‐Rimoldi, RG Mullen, BP Keene, S Khan, AS Paluch, ...
Journal of computational chemistry 38 (19), 1727-1739, 2017
1732017
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, 2013
832013
Wetting transition of the ethanol–water droplet on smooth and textured surfaces
AK Metya, S Khan, JK Singh
The Journal of Physical Chemistry C 118 (8), 4113-4121, 2014
622014
From microhydration to bulk hydration of Sr2+ metal ion: DFT, MP2 and molecular dynamics study
A Boda, S De, SM Ali, S Tulishetti, S Khan, JK Singh
Journal of Molecular Liquids 172, 110-118, 2012
312012
Can porous carbons be a remedy for PFAS pollution in water? A perspective
D Saha, S Khan, SE Van Bramer
Journal of Environmental Chemical Engineering 9 (6), 106665, 2021
202021
The wetting behavior of aqueous imidazolium based ionic liquids: a molecular dynamics study
S Bhattacharjee, S Khan
Physical Chemistry Chemical Physics 22 (16), 8595-8605, 2020
192020
Prewetting transitions of one site associating fluids
S Khan, JK Singh
The Journal of chemical physics 132 (14), 2010
182010
A-Priori screening of deep eutectic solvent for enhanced oil recovery application using COSMO-RS framework
DS Raut, VA Joshi, S Khan, D Kundu
Journal of Molecular Liquids 377, 121482, 2023
172023
Effect of alkyl chain length on the wetting behavior of imidazolium based ionic liquids: A molecular dynamics study
S Bhattacharjee, S Khan
Fluid Phase Equilibria 501, 112253, 2019
172019
Surface phase transition of associating fluids on functionalized surfaces
S Khan, JK Singh
The Journal of Physical Chemistry C 115 (36), 17861-17869, 2011
172011
Wetting behavior of aqueous 1-alkyl-3-methylimidazolium tetrafluoroborate {[Cn MIM][BF4](n= 2, 4, 6)} on graphite surface
S Bhattacharjee, D Chakraborty, S Khan
Chemical Engineering Science 229, 116078, 2021
122021
Structure and Dynamics of n-Alkanol Monolayers on a Mica Surface
D Bhandary, S Khan, JK Singh
The Journal of Physical Chemistry C 118 (13), 6809-6819, 2014
122014
Surface phase transitions of multiple-site associating fluids
S Khan, D Bhandary, JK Singh
Molecular Physics 110 (11-12), 1241-1248, 2012
102012
Vapour–liquid phase equilibria of simple fluids confined in patterned slit pores
SK Singh, S Khan, S Jana, JK Singh
Molecular Simulation 37 (05), 350-360, 2011
102011
Understanding wetting transitions using molecular simulation
TK Patra, S Khan, R Srivastava, JK Singh
Nanoscale and Microscale Phenomena: Fundamentals and Applications, 139-166, 2015
72015
Enhanced adsorption of perfluorooctanesulfonic acid (PFOS) in fluorine doped mesoporous carbon: Experiment and simulation
S Medha, Z Romisher, S Van Bramer, J Weyrich, S Khan, D Saha
Carbon 218, 118745, 2024
62024
Phase behaviour of confined associating fluid in a functionalized slit pore: a Monte Carlo study
SS Mandal, SK Singh, S Bhattacharjee, S Khan
Fluid Phase Equilibria 531, 112909, 2021
42021
Cylindrical droplet of aqueous ionic liquids on smooth and pillared graphite surface: A molecular dynamics study
D Chakraborty, S Bhattacharjee, S Khan
Chemical Engineering Science 277, 118812, 2023
32023
Quantification of the impact of water on the wetting behavior of hydrophilic ionic liquid: a molecular dynamics study
S Bhattacharjee, S Khan
Molecular Simulation 49 (6), 525-535, 2023
32023
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