The Myth of d8 Copper(III) IM DiMucci, JT Lukens, S Chatterjee, KM Carsch, CJ Titus, SJ Lee, ... Journal of the American Chemical Society 141 (46), 18508-18520, 2019 | 181 | 2019 |
Synthesis of a copper-supported triplet nitrene complex pertinent to copper-catalyzed amination KM Carsch, IM DiMucci, DA Iovan, A Li, SL Zheng, CJ Titus, SJ Lee, ... Science 365 (6458), 1138-1143, 2019 | 150 | 2019 |
Toward Models for the Full Oxygen-Evolving Complex of Photosystem II by Ligand Coordination To Lower the Symmetry of the Mn3CaO4 Cubane: Demonstration … JS Kanady, PH Lin, KM Carsch, RJ Nielsen, MK Takase, WA Goddard III, ... Journal of the American Chemical Society 136 (41), 14373-14376, 2014 | 145 | 2014 |
Variable Pathways for Oxygen Atom Insertion into Metal–Carbon Bonds: The Case of Cp*W(O)2(CH2SiMe3) J Mei, KM Carsch, CR Freitag, TB Gunnoe, TR Cundari Journal of the American Chemical Society 135 (1), 424-435, 2013 | 32 | 2013 |
Effects of Lewis Acidic Metal Ions (M) on Oxygen-Atom Transfer Reactivity of Heterometallic Mn3MO4 Cubane and Fe3MO(OH) and Mn3MO(OH) Clusters D Lionetti, S Suseno, EY Tsui, L Lu, TA Stich, KM Carsch, RJ Nielsen, ... Inorganic chemistry 58 (4), 2336-2345, 2019 | 29 | 2019 |
Accelerated Oxygen Atom Transfer and C−H Bond Oxygenation by Remote Redox Changes in Fe3Mn‐Iodosobenzene Adducts G De Ruiter, KM Carsch, S Gul, R Chatterjee, NB Thompson, MK Takase, ... Angewandte Chemie International Edition 56 (17), 4772-4776, 2017 | 29 | 2017 |
Electronic Structures and Reactivity Profiles of Aryl Nitrenoid-Bridged Dicopper Complexes KM Carsch, JT Lukens, IM DiMucci, DA Iovan, SL Zheng, KM Lancaster, ... Journal of the American Chemical Society 142 (5), 2264-2276, 2020 | 23 | 2020 |
Intramolecular C–H and C–F bond oxygenation by site-differentiated tetranuclear manganese models of the OEC KM Carsch, G De Ruiter, T Agapie Inorganic chemistry 56 (15), 9044-9054, 2017 | 16 | 2017 |
Selectivity of C−H versus C−F Bond Oxygenation by Homo‐ and Heterometallic Fe4, Fe3Mn, and Mn4 Clusters G de Ruiter, KM Carsch, MK Takase, T Agapie Chemistry–A European Journal 23 (45), 10744-10748, 2017 | 14 | 2017 |
DFT modeling of a methane-to-methanol catalytic cycle via Group 6 organometallics: The role of metal in determining the mode of C–H activation KM Carsch, TR Cundari Computational and Theoretical Chemistry 980, 133-137, 2012 | 14 | 2012 |
Reversible Scavenging of Dioxygen from Air by a Copper Complex KM Carsch, A Iliescu, RD McGillicuddy, JA Mason, TA Betley Journal of the American Chemical Society 143 (43), 18346-18352, 2021 | 13 | 2021 |
Prediction of multiple hydrogen ligation at a vanadium (II) site in a metal–organic framework R Chakraborty, KM Carsch, DE Jaramillo, Y Yabuuchi, H Furukawa, ... The journal of physical chemistry letters 13 (44), 10471-10478, 2022 | 7 | 2022 |
Syntheses and solid-state structures of two cofacial (bis) dipyrrin dichromium complexes in different charge states K Carsch, SE Elder, DK Dogutan, DG Nocera, J Yang, SL Zheng, T Daniel, ... Acta Crystallographica Section C: Structural Chemistry 77 (3), 161-166, 2021 | 5 | 2021 |
Selective adsorption of oxygen from humid air in a metal–organic framework with trigonal pyramidal copper (I) sites KM Carsch, AJ Huang, MN Dods, ST Parker, RC Rohde, HZH Jiang, ... Journal of the American Chemical Society 146 (5), 3160-3170, 2024 | 3 | 2024 |
Quantum chemical modeling of hydrogen binding in metal–organic frameworks: validation, insight, predictions and challenges R Chakraborty, JJ Talbot, H Shen, Y Yabuuchi, KM Carsch, HZH Jiang, ... Physical Chemistry Chemical Physics 26 (8), 6490-6511, 2024 | 3 | 2024 |
Nitrene transfer from a sterically confined copper nitrenoid dipyrrin complex KM Carsch, SC North, IM DiMucci, A Iliescu, P Vojáčková, T Khazanov, ... Chemical Science 14 (39), 10847-10860, 2023 | 3 | 2023 |
Assessment of Adsorbate π-Backbonding in Copper (I) Metal–Organic Frameworks via Multinuclear NMR Spectroscopy and Density Functional Theory Calculations LM Funke, R Chakraborty, KM Carsch, M Head-Gordon, JR Long, ... The Journal of Physical Chemistry C 127 (15), 7513-7519, 2023 | 2 | 2023 |
Crystal structure of the RuPhos ligand KM Carsch, W Ho, KH Lui, G Valtierra, DK Dogutan, DG Nocera, ... Acta Crystallographica Section E: Crystallographic Communications 77 (2 …, 2021 | 2 | 2021 |
Computational Optimization of Room Temperature Usable Capacity for Hydrogen Storage in MFU-4-Type Metal–Organic Frameworks via Pairwise Metal Substitutions NV Tkachenko, Y Yabuuchi, KM Carsch, H Furukawa, JR Long, ... | | 2024 |
Geometric Tuning of Coordinatively Unsaturated Copper (I) Sites in Metal–Organic Frameworks for Ambient-Temperature Hydrogen Storage Y Yabuuchi, H Furukawa, KM Carsch, RA Klein, NV Tkachenko, ... | | 2024 |