High-Throughput Experimentation, Theoretical Modeling, and Human Intuition: Lessons Learned in Metal–Organic-Framework-Supported Catalyst Design
McCullough, Katherine E., King, Daniel S., Chheda, Saumil P., Ferrandon, Magali S., Goetjen, Timothy A., Syed, Zoha H., Graham, Trent R., Washton, Nancy M., Farha, Omar K., Gagliardi, Laura, Delferro, Massimiliano
Published in ACS central science (22.02.2023)
Published in ACS central science (22.02.2023)
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Journal Article
Evolution of water structures in metal-organic frameworks for improved atmospheric water harvesting
Hanikel, Nikita, Pei, Xiaokun, Chheda, Saumil, Lyu, Hao, Jeong, WooSeok, Sauer, Joachim, Gagliardi, Laura, Yaghi, Omar M
Published in Science (American Association for the Advancement of Science) (22.10.2021)
Published in Science (American Association for the Advancement of Science) (22.10.2021)
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Journal Article
High-Temperature Water Adsorption Isotherms and Ambient Temperature Water Diffusion Rates on Water Harvesting Metal–Organic Frameworks
Hastings, Jon, Lassitter, Thomas, Zheng, Zhiling, Chheda, Saumil, Siepmann, J. Ilja, Gagliardi, Laura, Yaghi, Omar M., Glover, T. Grant
Published in Journal of physical chemistry. C (11.07.2024)
Published in Journal of physical chemistry. C (11.07.2024)
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Journal Article
Shaping the Water-Harvesting Behavior of Metal–Organic Frameworks Aided by Fine-Tuned GPT Models
Zheng, Zhiling, Alawadhi, Ali H., Chheda, Saumil, Neumann, S. Ephraim, Rampal, Nakul, Liu, Shengchao, Nguyen, Ha L., Lin, Yen-hsu, Rong, Zichao, Siepmann, J. Ilja, Gagliardi, Laura, Anandkumar, Anima, Borgs, Christian, Chayes, Jennifer T., Yaghi, Omar M.
Published in Journal of the American Chemical Society (27.12.2023)
Published in Journal of the American Chemical Society (27.12.2023)
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Journal Article
Harvesting Water from Air with High-Capacity, Stable Furan-Based Metal–Organic Frameworks
Alawadhi, Ali H., Chheda, Saumil, Stroscio, Gautam D., Rong, Zichao, Kurandina, Daria, Nguyen, Ha L., Rampal, Nakul, Zheng, Zhiling, Gagliardi, Laura, Yaghi, Omar M.
Published in Journal of the American Chemical Society (24.01.2024)
Published in Journal of the American Chemical Society (24.01.2024)
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Journal Article
Mechanism of Methanol Dehydration Catalyzed by Al8O12 Nodes Assisted by Linker Amine Groups of the Metal–Organic Framework CAU‑1
Yang, Dong, Chheda, Saumil, Lyu, Yinghui, Li, Ziang, Xiao, Yue, Siepmann, J. Ilja, Gagliardi, Laura, Gates, Bruce C.
Published in ACS catalysis (21.10.2022)
Published in ACS catalysis (21.10.2022)
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Journal Article
Mechanism of Methanol Dehydration Catalyzed by Al 8 O 12 Nodes Assisted by Linker Amine Groups of the Metal–Organic Framework CAU-1
Yang, Dong, Chheda, Saumil, Lyu, Yinghui, Li, Ziang, Xiao, Yue, Siepmann, J. Ilja, Gagliardi, Laura, Gates, Bruce C.
Published in ACS catalysis (21.10.2022)
Published in ACS catalysis (21.10.2022)
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Journal Article
Site Densities, Rates, and Mechanism of Stable Ni/UiO-66 Ethylene Oligomerization Catalysts
Yeh, Benjamin, Vicchio, Stephen P, Chheda, Saumil, Zheng, Jian, Schmid, Julian, Löbbert, Laura, Bermejo-Deval, Ricardo, Gutiérrez, Oliver Y, Lercher, Johannes A, Lu, Connie C, Neurock, Matthew, Getman, Rachel B, Gagliardi, Laura, Bhan, Aditya
Published in Journal of the American Chemical Society (08.12.2021)
Published in Journal of the American Chemical Society (08.12.2021)
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Journal Article
Structure and Site Evolution of Framework Ni Species in MIL-127 MOFs for Propylene Oligomerization Catalysis
Yeh, Benjamin, Chheda, Saumil, Prinslow, Steven D., Hoffman, Adam S., Hong, Jiyun, Perez-Aguilar, Jorge E., Bare, Simon R., Lu, Connie C., Gagliardi, Laura, Bhan, Aditya
Published in Journal of the American Chemical Society (15.02.2023)
Published in Journal of the American Chemical Society (15.02.2023)
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Journal Article
Linker Contribution toward Stability of Metal–Organic Frameworks under Ionizing Radiation
Fairley, Melissa, Gilson, Sara E, Hanna, Sylvia L, Mishra, Anushrut, Knapp, Julia G, Idrees, Karam B, Chheda, Saumil, Traustason, Hrafn, Islamoglu, Timur, Burns, Peter C, Gagliardi, Laura, Farha, Omar K, LaVerne, Jay A
Published in Chemistry of materials (14.12.2021)
Published in Chemistry of materials (14.12.2021)
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Journal Article
Influence of 1‑Butene Adsorption on the Dimerization Activity of Single Metal Cations on UiO-66 Nodes
Löbbert, Laura, Chheda, Saumil, Zheng, Jian, Khetrapal, Navneet, Schmid, Julian, Zhao, Ruixue, Gaggioli, Carlo A., Camaioni, Donald M., Bermejo-Deval, Ricardo, Gutiérrez, Oliver Y., Liu, Yue, Siepmann, J. Ilja, Neurock, Matthew, Gagliardi, Laura, Lercher, Johannes A.
Published in Journal of the American Chemical Society (18.01.2023)
Published in Journal of the American Chemical Society (18.01.2023)
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Journal Article
Metal-organic framework supported single-site nickel catalysts for butene dimerization
Zheng, Jian, Löbbert, Laura, Chheda, Saumil, Khetrapal, Navneet, Schmid, Julian, Gaggioli, Carlo Alberto, Yeh, Benjamin, Bermejo-Deval, Ricardo, Motkuri, Radha Kishan, Balasubramanian, Mahalingam, Fulton, John L., Gutiérrez, Oliver Y., Siepmann, J. Ilja, Neurock, Matthew, Gagliardi, Laura, Lercher, Johannes A.
Published in Journal of catalysis (01.09.2022)
Published in Journal of catalysis (01.09.2022)
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Journal Article
MOF Linker Extension Strategy for Enhanced Atmospheric Water Harvesting
Hanikel, Nikita, Kurandina, Daria, Chheda, Saumil, Zheng, Zhiling, Rong, Zichao, Neumann, S. Ephraim, Sauer, Joachim, Siepmann, J. Ilja, Gagliardi, Laura, Yaghi, Omar M.
Published in ACS central science (22.03.2023)
Published in ACS central science (22.03.2023)
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Journal Article
Validation of the Cossee–Arlman mechanism for propylene oligomerization on Ni/UiO-66
Yeh, Benjamin, Chheda, Saumil, Zheng, Jian, Schmid, Julian, Löbbert, Laura, Bermejo-Deval, Ricardo, Gutiérrez, Oliver Y., Lercher, Johannes A., Gagliardi, Laura, Bhan, Aditya
Published in Catalysis science & technology (21.06.2023)
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Published in Catalysis science & technology (21.06.2023)
Journal Article
Linker Contribution toward Stability of Metal–Organic Frameworks under Ionizing Radiation
Fairley, Melissa, Gilson, Sara E., Hanna, Sylvia L., Mishra, Anushrut, Knapp, Julia G., Idrees, Karam B., Chheda, Saumil, Traustason, Hrafn, Islamoglu, Timur, Burns, Peter C., Gagliardi, Laura, Farha, Omar K., LaVerne, Jay A.
Published in Chemistry of materials (15.11.2021)
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Published in Chemistry of materials (15.11.2021)
Journal Article
Validation of the Cossee-Arlman mechanism for propylene oligomerization on Ni/UiO-66
Yeh, Benjamin, Chheda, Saumil, Zheng, Jian, Schmid, Julian, Löbbert, Laura, Bermejo-Deval, Ricardo, Gutiérrez, Oliver Y, Lercher, Johannes A, Gagliardi, Laura, Bhan, Aditya
Published in Catalysis science & technology (18.07.2023)
Published in Catalysis science & technology (18.07.2023)
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Journal Article
Discovery of spontaneous de-interpenetration through charged point-point repulsions
Hanna, Sylvia L., Chheda, Saumil, Anderson, Ryther, Ray, Debmalya, Malliakas, Christos D., Knapp, Julia G., Otake, Ken-ichi, Li, Peng, Li, Penghao, Wang, Xingjie, Wasson, Megan C., Zosel, Katarina, Evans, Austin M., Robison, Lee, Islamoglu, Timur, Zhang, Xuan, Dichtel, William R., Stoddart, J. Fraser, Gomez-Gualdron, Diego A., Gagliardi, Laura, Farha, Omar K.
Published in Chem (13.01.2022)
Published in Chem (13.01.2022)
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Journal Article