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The last 5 uploaded publications
Selective Methane Oxidation to Methanol on Cu-Oxo Dimers Stabilized by Zirconia Nodes of an NU-1000 Metal–Organic Framework
Jian Zheng, Jingyun Ye, Manuel Á. Ortuño, John L. Fulton, Oliver Y. Gutiérrez, Donald M. Camaioni, Radha Kishan Motkuri, Zhanyong Li, Thomas E. Webber, B. Layla Mehdi, Nigel D. Browning, R. Lee Penn, Omar K. Farha, Joseph T. Hupp, Donald G Truhlar, Christopher J. Cramer, Johannes A. Lercher (2019). Selective Methane Oxidation to Methanol on Cu-Oxo Dimers Stabilized by Zirconia Nodes of an NU-1000 Metal–Organic Framework. , 141(23), DOI: https://doi.org/10.1021/jacs.9b02902.
Article14 days agoPresence versus Proximity: The Role of Pendant Amines in the Catalytic Hydrolysis of a Nerve Agent Simulant
Timur İslamoğlu, Manuel Á. Ortuño, Emmanuel Proussaloglou, Ashlee J. Howarth, Nicolaas A. Vermeulen, Ahmet Atilgan, Abdullah Mohamed Asiri, Christopher J. Cramer, Omar K. Farha (2018). Presence versus Proximity: The Role of Pendant Amines in the Catalytic Hydrolysis of a Nerve Agent Simulant. , 130(7), DOI: https://doi.org/10.1002/ange.201712645.
Article15 days agoAtomistic Approach toward Selective Photocatalytic Oxidation of a Mustard-Gas Simulant: A Case Study with Heavy-Chalcogen-Containing PCN-57 Analogues
Subhadip Goswami, Claire E. Miller, Jenna L. Logsdon, Cassandra T. Buru, Yi‐Lin Wu, David N. Bowman, Timur İslamoğlu, Abdullah Mohamed Asiri, Christopher J. Cramer, Michael R. Wasielewski, Joseph T. Hupp, Omar K. Farha (2017). Atomistic Approach toward Selective Photocatalytic Oxidation of a Mustard-Gas Simulant: A Case Study with Heavy-Chalcogen-Containing PCN-57 Analogues. , 9(23), DOI: https://doi.org/10.1021/acsami.7b07055.
Article15 days agoPresence versus Proximity: The Role of Pendant Amines in the Catalytic Hydrolysis of a Nerve Agent Simulant
Timur İslamoğlu, Manuel Á. Ortuño, Emmanuel Proussaloglou, Ashlee J. Howarth, Nicolaas A. Vermeulen, Ahmet Atilgan, Abdullah Mohamed Asiri, Christopher J. Cramer, Omar K. Farha (2018). Presence versus Proximity: The Role of Pendant Amines in the Catalytic Hydrolysis of a Nerve Agent Simulant. , 57(7), DOI: https://doi.org/10.1002/anie.201712645.
Article15 days agoLocalized Active Space Pair-Density Functional Theory
Riddhish Pandharkar, Matthew R. Hermes, Christopher J. Cramer, Donald G Truhlar, Laura Gagliardi (2021). Localized Active Space Pair-Density Functional Theory. , DOI: https://doi.org/10.26434/chemrxiv.13604498.v1.
Preprint14 days ago