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Siddharth Gautam
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Propane–water mixtures confined within cylindrical silica nanopores: structural and dynamical properties probed by molecular dynamics
TTB Le, A Striolo, SS Gautam, DR Cole
Langmuir 33 (42), 11310-11320, 2017
392017
Diffusion of acetylene inside Na− Y zeolite: Molecular dynamics simulation studies
S Gautam, S Mitra, R Mukhopadhyay, SL Chaplot
Physical Review E 74 (4), 041202, 2006
392006
Dynamics of water sorbed in reverse osmosis polyamide membrane
VK Sharma, PS Singh, S Gautam, P Maheshwari, D Dutta, ...
Journal of Membrane Science 326 (2), 667-671, 2009
352009
Dynamics of propane in nanoporous silica aerogel: A quasielastic neutron scattering study
S Gautam, T Liu, G Rother, N Jalarvo, E Mamontov, S Welch, J Sheets, ...
The Journal of Physical Chemistry C 119 (32), 18188-18195, 2015
342015
Role of Confinement on Adsorption and Dynamics of Ethane and an Ethane–CO2 Mixture in Mesoporous CPG Silica
S Patankar, S Gautam, G Rother, A Podlesnyak, G Ehlers, T Liu, DR Cole, ...
The Journal of Physical Chemistry C 120 (9), 4843-4853, 2016
332016
Structure and dynamics of confined COH fluids relevant to the subsurface: application of magnetic resonance, neutron scattering, and molecular dynamics simulations
SS Gautam, S Ok, DR Cole
Frontiers in Earth Science 5, 43, 2017
302017
Dynamics of absorbed water in saponite clay: Neutron scattering study
D Chakrabarty, S Gautam, S Mitra, A Gil, MA Vicente, R Mukhopadhyay
Chemical physics letters 426 (4-6), 296-300, 2006
282006
Dynamics of adsorbed hydrocarbon in nanoporous zeolite framework
VK Sharma, S Gautam, S Mitra, MN Rao, AK Tripathi, SL Chaplot, ...
The Journal of Physical Chemistry B 113 (23), 8066-8072, 2009
272009
Diffusion of water in nanoporous NF polyamide membrane
VK Sharma, PS Singh, S Gautam, S Mitra, R Mukhopadhyay
Chemical Physics Letters 478 (1-3), 56-60, 2009
262009
Sorption, Structure and Dynamics of CO2 and Ethane in Silicalite at High Pressure: A Combined Monte Carlo and Molecular Dynamics Simulation Study
S Gautam, T Liu, D Cole
Molecules 24 (1), 99, 2018
252018
Water uptake by silica nanopores: impacts of surface hydrophilicity and pore size
G Rother, AG Stack, S Gautam, T Liu, DR Cole, A Busch
The Journal of Physical Chemistry C 124 (28), 15188-15194, 2020
242020
Molecular dynamics simulations of propane in slit shaped silica nano-pores: direct comparison with quasielastic neutron scattering experiments
S Gautam, T Le, A Striolo, D Cole
Physical Chemistry Chemical Physics 19 (48), 32320-32332, 2017
242017
Location dependent orientational structure and dynamics of ethane in ZSM5
S Gautam, T Liu, S Patankar, D Tomasko, D Cole
Chemical Physics Letters 648, 130-136, 2016
222016
Rotational dynamics of propylene in ZSM-5 zeolitic frameworks
S Gautam, VK Sharma, S Mitra, SL Chaplot, R Mukhopadhyay
Chemical Physics Letters 501 (4-6), 345-350, 2011
222011
Effects of water on the stochastic motions of propane confined in MCM-41-S pores
S Gautam, TTB Le, G Rother, N Jalarvo, T Liu, E Mamontov, S Dai, ...
Physical Chemistry Chemical Physics 21 (45), 25035-25046, 2019
212019
Effects of confinement and pressure on the vibrational behavior of nano-confined propane
S Gautam, AI Kolesnikov, G Rother, S Dai, ZA Qiao, D Cole
The Journal of Physical Chemistry A 122 (33), 6736-6745, 2018
212018
Dynamics of propylene adsorbed in Na-Y and Na-ZSM5 zeolites: a QENS and MD simulation study
VK Sharma, S Gautam, S Mitra, R Mukhopadhyay
Zeitschrift für Physikalische Chemie 224 (1-2), 133-152, 2010
212010
Diffusion of propylene adsorbed in Na-Y and Na-ZSM5 zeolites: Neutron scattering and FTIR studies
S Gautam, AK Tripathi, VS Kamble, S Mitra, R Mukhopadhyay
Pramana 71, 1153-1157, 2008
212008
Dynamics of 1, 3-butadiene adsorbed in Na-Y zeolite: A molecular dynamics simulation study
S Gautam, S Mitra, SL Chaplot, R Mukhopadhyay
Physical Review E 77 (6), 061201, 2008
212008
CO2 Adsorption in Metal-Organic Framework Mg-MOF-74: Effects of Inter-Crystalline Space
S Gautam, D Cole
Nanomaterials 10 (11), 2274, 2020
182020
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