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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Journal Article
Deep neural network learning of complex binary sorption equilibria from molecular simulation data
Sun, Yangzesheng, DeJaco, Robert F, Siepmann, J Ilja
Published in Chemical science (Cambridge) (28.04.2019)
Published in Chemical science (Cambridge) (28.04.2019)
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Journal Article
Assessing the Quality of Molecular Simulations for Vapor–Liquid Equilibria: An Analysis of the TraPPE Database
Eggimann, Becky L, Sun, Yangzesheng, DeJaco, Robert F, Singh, Ramanish, Ahsan, Muhammad, Josephson, Tyler R, Siepmann, J. Ilja
Published in Journal of chemical and engineering data (12.03.2020)
Published in Journal of chemical and engineering data (12.03.2020)
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Journal Article
Binding, brightness, or noise? Extracting temperature-dependent properties of dye bound to DNA
DeJaco, Robert F., Majikes, Jacob M., Liddle, J. Alexander, Kearsley, Anthony J.
Published in Biophysical journal (04.04.2023)
Published in Biophysical journal (04.04.2023)
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Journal Article
Comparative Study of the Effect of Defects on Selective Adsorption of Butanol from Butanol/Water Binary Vapor Mixtures in Silicalite‑1 Films
Farzaneh, Amirfarrokh, DeJaco, Robert F, Ohlin, Lindsay, Holmgren, Allan, Siepmann, J. Ilja, Grahn, Mattias
Published in Langmuir (29.08.2017)
Published in Langmuir (29.08.2017)
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Journal Article
Reducing Bias and Quantifying Uncertainty in Fluorescence Produced by PCR
DeJaco, Robert F., Roberts, Matthew J., Romsos, Erica L., Vallone, Peter M., Kearsley, Anthony J.
Published in Bulletin of mathematical biology (01.09.2023)
Published in Bulletin of mathematical biology (01.09.2023)
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Journal Article
Modeling and simulation of gas separations with spiral‐wound membranes
DeJaco, Robert F., Loprete, Kenneth, Pennisi, Kenneth, Majumdar, Sudip, Siepmann, J. Ilja, Daoutidis, Prodromos, Murnen, Hannah, Tsapatsis, Michael
Published in AIChE journal (01.08.2020)
Published in AIChE journal (01.08.2020)
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Journal Article
Fingerprinting diverse nanoporous materials for optimal hydrogen storage conditions using meta-learning
Sun, Yangzesheng, DeJaco, Robert F., Li, Zhao, Tang, Dai, Glante, Stephan, Sholl, David S., Colina, Coray M., Snurr, Randall Q., Thommes, Matthias, Hartmann, Martin, Siepmann, J. Ilja
Published in Science advances (01.07.2021)
Published in Science advances (01.07.2021)
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Journal Article
Molecular Simulation of Olefin Oligomer Blend Phase Behavior
Chen, Qile P, Chu, Justine D, DeJaco, Robert F, Lodge, Timothy P, Siepmann, J. Ilja
Published in Macromolecules (24.05.2016)
Published in Macromolecules (24.05.2016)
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Journal Article
Vapor‐ and liquid‐phase adsorption of alcohol and water in silicalite‐1 synthesized in fluoride media
DeJaco, Robert F., Dorneles de Mello, Matheus, Nguyen, Huong Giang T., Jeon, Mi Young, Zee, Roger D., Tsapatsis, Michael, Siepmann, Joern Ilja
Published in AIChE journal (01.04.2020)
Published in AIChE journal (01.04.2020)
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Journal Article
Cooperative Catalysis by Surface Lewis Acid/Silanol for Selective Fructose Etherification on Sn-SPP Zeolite
Josephson, Tyler R, DeJaco, Robert F, Pahari, Swagata, Ren, Limin, Guo, Qiang, Tsapatsis, Michael, Siepmann, J. Ilja, Vlachos, Dionisios G, Caratzoulas, Stavros
Published in ACS catalysis (05.10.2018)
Published in ACS catalysis (05.10.2018)
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Journal Article
A Review of Biorefinery Separations for Bioproduct Production via Thermocatalytic Processing
Nguyen, Hannah, DeJaco, Robert F, Mittal, Nitish, Siepmann, J. Ilja, Tsapatsis, Michael, Snyder, Mark A, Fan, Wei, Saha, Basudeb, Vlachos, Dionisios G
Published in Annual review of chemical and biomolecular engineering (07.06.2017)
Published in Annual review of chemical and biomolecular engineering (07.06.2017)
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Journal Article
Understanding fast adsorption in single-solute breakthrough curves
DeJaco, Robert F., Kearsley, Anthony J.
Published in Communications in nonlinear science & numerical simulation (01.04.2024)
Published in Communications in nonlinear science & numerical simulation (01.04.2024)
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Journal Article
Deep neural network learning of complex binary sorption equilibria from molecular simulation dataElectronic supplementary information (ESI) available: Experimental details for machine learning and Monte Carlo simulation for binary sorption systems investigated, neural network prediction results for equilibrium loadings in systems other than MFI-C5-W, and additional method details for desorption operation optimization. See DOI: 10.1039/c8sc05340e
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Journal Article
Deep neural network learning of complex binary sorption equilibria from molecular simulation data† †Electronic supplementary information (ESI) available: Experimental details for machine learning and Monte Carlo simulation for binary sorption systems investigated, neural network prediction results for equilibrium loadings in systems other than MFI-C5-W, and additional method details for desorption operation optimization. See DOI: 10.1039/c8sc05340e
Sun, Yangzesheng, DeJaco, Robert F., Siepmann, J. Ilja
Published in Chemical science (Cambridge) (18.03.2019)
Published in Chemical science (Cambridge) (18.03.2019)
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Journal Article
Deep neural network learning of complex binary sorption equilibria from molecular simulation data
Sun, Yangzesheng, DeJaco, Robert F., Siepmann, J. Ilja
Published in Chemical science (Cambridge) (01.01.2019)
Published in Chemical science (Cambridge) (01.01.2019)
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Journal Article
Modeling and simulation of gas separations with spiral–wound membranes
DeJaco, Robert F., Loprete, Kenneth, Pennisi, Kenneth, Majumdar, Sudip, Siepmann, J. Ilja, Daoutidis, Prodromos, Murnen, Hannah, Tsapatsis, Michael
Published in AIChE journal (15.05.2020)
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Published in AIChE journal (15.05.2020)
Journal Article