Krishna Mohan Gupta

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Jianwen JiangDepartment of Chemical and Biomolecular Engineering, National University of SingaporeVerified email at nus.edu.sg
ruifeng luNanjing University of Science and TechnologyVerified email at njust.edu.cn
Yuhong QianNational University of SingaporeVerified email at u.nus.edu
Dan ZhaoChemical & Biomolecular Engineering, National University of SingaporeVerified email at nus.edu.sg
Xuerui WangNanjing Tech UniversityVerified email at njtech.edu.cn
Dr. Tamas PandaAssistant Professor VIT, Vellore, Newyork University, Kyoto University, NCL PuneVerified email at vit.ac.in
Praveen LingaProfessor of Chemical and Biomolecular Engineering, National University of SingaporeVerified email at nus.edu.sg
Zhiwei QiaoNational University of SingaporeVerified email at nus.edu.sg
Kang ZhangAssociate Professor of Nanjing University of Information Science & Technology
Kang ZhangMacau University of Science and TechnologyVerified email at must.edu.mo
Liu Zhihongwuhan universityVerified email at whu.edu.cn

Krishna Mohan Gupta

Scientist, Institute of Sustainability for Chemicals, Energy and Environment (ISCE2), A*STAR

Verified email at isce2.a-star.edu.sg

Molecular Modeling & Simulation Membrane Separation(MOF&COF)Formulation and Crystallization Understanding Skin Permeation


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Reversed thermo-switchable molecular sieving membranes composed of two-dimensional metal-organic nanosheets for gas separation X Wang, C Chi, K Zhang, Y Qian, KM Gupta, Z Kang, J Jiang, D Zhao Nature communications 8 (1), 14460, 2017	442	2017
Molecular dynamics study on water desalination through functionalized nanoporous graphene Y Wang, Z He, KM Gupta, Q Shi, R Lu Carbon 116, 120-127, 2017	226	2017
Catalytic amino acid production from biomass-derived intermediates W Deng, Y Wang, S Zhang, KM Gupta, MJ Hülsey, H Asakura, L Liu, ... Proceedings of the National Academy of Sciences 115 (20), 5093-5098, 2018	185	2018
Synthesis and seawater desalination of molecular sieving zeolitic imidazolate framework membranes Y Zhu, KM Gupta, Q Liu, J Jiang, J Caro, A Huang Desalination 385, 75-82, 2016	157	2016
Cellulose dissolution and regeneration in ionic liquids: A computational perspective KM Gupta, J Jiang Chemical Engineering Science 121, 180-189, 2015	145	2015
Ionic Liquid/Metal–Organic Framework Composite for CO₂ Capture: A Computational Investigation Y Chen, Z Hu, KM Gupta, J Jiang The Journal of Physical Chemistry C 115 (44), 21736-21742, 2011	140	2011
Metal–organic framework supported ionic liquid membranes for CO 2 capture: anion effects KM Gupta, Y Chen, Z Hu, J Jiang Physical Chemistry Chemical Physics 14 (16), 5785-5794, 2012	134	2012
Water desalination through zeolitic imidazolate framework membranes: significant role of functional groups KM Gupta, K Zhang, J Jiang Langmuir 31 (48), 13230-13237, 2015	124	2015
Computational design of 2D functional covalent–organic framework membranes for water desalination K Zhang, Z He, KM Gupta, J Jiang Environmental Science: Water Research & Technology 3 (4), 735-743, 2017	112	2017
Ionic Liquid Membranes Supported by Hydrophobic and Hydrophilic Metal–Organic Frameworks for CO₂ Capture KM Gupta, Y Chen, J Jiang The Journal of Physical Chemistry C 117 (11), 5792-5799, 2013	98	2013
Molecular Insights into the Nucleation and Growth of CH₄ and CO₂ Mixed Hydrates from Microsecond Simulations Z He, KM Gupta, P Linga, J Jiang The Journal of Physical Chemistry C 120 (44), 25225-25236, 2016	87	2016
Cellulose regeneration from a cellulose/ionic liquid mixture: the role of anti-solvents K M. Gupta, Z Hu, J Jiang RSC Adv., 2013	84	2013
Seawater pervaporation through zeolitic imidazolate framework membranes: Atomistic simulation study KM Gupta, Z Qiao, K Zhang, J Jiang ACS Applied Materials & Interfaces 8 (21), 13392-13399, 2016	77	2016
Molecular insight into cellulose regeneration from a cellulose/ionic liquid mixture: effects of water concentration and temperature KM Gupta, Z Hu, J Jiang RSC advances 3 (13), 4425-4433, 2013	61	2013
Mechanistic understanding of interactions between cellulose and ionic liquids: A molecular simulation study KM Gupta, Z Hu, J Jiang Polymer 52 (25), 5904-5911, 2011	60	2011
Systematic Investigation of Nitrile-Based Ionic Liquids for CO2 Capture: A Combination of Molecular Simulation and Ab Initio Calculation K M. Gupta, J Jiang The Journal of Physical Chemistry C, 2014	52	2014
Gas permeation through double-layer graphene oxide membranes: The role of interlayer distance and pore offset Q Liu, KM Gupta, Q Xu, G Liu, W Jin Separation and Purification Technology 209, 419-425, 2019	47	2019
Efficient ethanol/water separation via functionalized nanoporous graphene membranes: insights from molecular dynamics study Q Shi, Z He, KM Gupta, Y Wang, R Lu Journal of Materials Science 52, 173-184, 2017	44	2017
Efficient Removal of Pb²⁺ from Aqueous Solution by an Ionic Covalent–Organic Framework: Molecular Simulation Study KM Gupta, K Zhang, J Jiang Industrial & Engineering Chemistry Research 57 (18), 6477-6482, 2018	36	2018
Enhancement of CO 2 uptake in iso-reticular Co based zeolitic imidazolate frameworks via metal replacement T Panda, KM Gupta, J Jiang, R Banerjee CrystEngComm 16 (22), 4677-4680, 2014	34	2014

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