Simultaneously Enhanced Hydrophilicity and Stability of a Metal‐Organic Framework via Post‐Synthetic Modification for Water Vapor Sorption/Desorption
Luo, Tian‐Yi, Park, Sunghwan, Chen, Tso‐Hsuan, Prerna, Patel, Roshan, Li, Xinyu, Ilja Siepmann, J., Caratzoulas, Stavros, Xia, Zhiyong, Tsapatsis, Michael
Published in Angewandte Chemie (International ed.) (02.11.2022)
Published in Angewandte Chemie (International ed.) (02.11.2022)
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Ultra-selective high-flux membranes from directly synthesized zeolite nanosheets
Jeon, Mi Young, Kim, Donghun, Kumar, Prashant, Lee, Pyung Soo, Rangnekar, Neel, Bai, Peng, Shete, Meera, Elyassi, Bahman, Lee, Han Seung, Narasimharao, Katabathini, Basahel, Sulaiman Nasir, Al-Thabaiti, Shaeel, Xu, Wenqian, Cho, Hong Je, Fetisov, Evgenii O., Thyagarajan, Raghuram, DeJaco, Robert F., Fan, Wei, Mkhoyan, K. Andre, Siepmann, J. Ilja, Tsapatsis, Michael
Published in Nature (London) (30.03.2017)
Published in Nature (London) (30.03.2017)
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One-dimensional intergrowths in two-dimensional zeolite nanosheets and their effect on ultra-selective transport
Kumar, Prashant, Kim, Dae Woo, Rangnekar, Neel, Xu, Hao, Fetisov, Evgenii O., Ghosh, Supriya, Zhang, Han, Xiao, Qiang, Shete, Meera, Siepmann, J. Ilja, Dumitrica, Traian, McCool, Benjamin, Tsapatsis, Michael, Mkhoyan, K. Andre
Published in Nature materials (01.04.2020)
Published in Nature materials (01.04.2020)
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Isobaric−Isothermal Molecular Dynamics Simulations Utilizing Density Functional Theory: An Assessment of the Structure and Density of Water at Near-Ambient Conditions
Schmidt, Jochen, VandeVondele, Joost, Kuo, I.-F. William, Sebastiani, Daniel, Siepmann, J. Ilja, Hutter, Jürg, Mundy, Christopher J
Published in The journal of physical chemistry. B (03.09.2009)
Published in The journal of physical chemistry. B (03.09.2009)
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Discovery of optimal zeolites for challenging separations and chemical transformations using predictive materials modeling
Bai, Peng, Jeon, Mi Young, Ren, Limin, Knight, Chris, Deem, Michael W., Tsapatsis, Michael, Siepmann, J. Ilja
Published in Nature communications (21.01.2015)
Published in Nature communications (21.01.2015)
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Energetics of Atmospherically Implicated Clusters Made of Sulfuric Acid, Ammonia, and Dimethyl Amine
Leverentz, Hannah R, Siepmann, J. Ilja, Truhlar, Donald G, Loukonen, Ville, Vehkamäki, Hanna
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (09.05.2013)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (09.05.2013)
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Supersaturated calcium carbonate solutions are classical
Henzler, Katja, Fetisov, Evgenii O, Galib, Mirza, Baer, Marcel D, Legg, Benjamin A, Borca, Camelia, Xto, Jacinta M, Pin, Sonia, Fulton, John L, Schenter, Gregory K, Govind, Niranjan, Siepmann, J Ilja, Mundy, Christopher J, Huthwelker, Thomas, De Yoreo, James J
Published in Science advances (01.01.2018)
Published in Science advances (01.01.2018)
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Acid-base chemical reaction model for nucleation rates in the polluted atmospheric boundary layer
Chen, Modi, Titcombe, Mari, Jiang, Jingkun, Jen, Coty, Kuang, Chongai, Fischer, Marc L., Eisele, Fred L., Siepmann, J. Ilja, Hanson, David R., Zhao, Jun, McMurry, Peter H.
Published in Proceedings of the National Academy of Sciences - PNAS (13.11.2012)
Published in Proceedings of the National Academy of Sciences - PNAS (13.11.2012)
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Open‐source molecular modeling software in chemical engineering focusing on the Molecular Simulation Design Framework
Cummings, Peter T., McCabe, Clare, Iacovella, Christopher R., Ledeczi, Akos, Jankowski, Eric, Jayaraman, Arthi, Palmer, Jeremy C., Maginn, Edward J., Glotzer, Sharon C., Anderson, Joshua A., Ilja Siepmann, J., Potoff, Jeffrey, Matsumoto, Ray A., Gilmer, Justin B., DeFever, Ryan S., Singh, Ramanish, Crawford, Brad
Published in AIChE journal (01.03.2021)
Published in AIChE journal (01.03.2021)
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Journal Article
Retention Mechanism in Reversed-Phase Liquid Chromatography: A Molecular Perspective
Rafferty, Jake L, Zhang, Ling, Siepmann, J. Ilja, Schure, Mark R
Published in Analytical chemistry (Washington) (01.09.2007)
Published in Analytical chemistry (Washington) (01.09.2007)
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Molecular simulation studies of reversed-phase liquid chromatography
Lindsey, Rebecca K., Rafferty, Jake L., Eggimann, Becky L., Siepmann, J. Ilja, Schure, Mark R.
Published in Journal of Chromatography A (26.04.2013)
Published in Journal of Chromatography A (26.04.2013)
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