| Methane oxidation to methanol catalyzed by Cu-oxo clusters stabilized in NU-1000 metal–organic framework T Ikuno, J Zheng, A Vjunov, M Sanchez-Sanchez, MA Ortuño, DR Pahls, ... Journal of the American Chemical Society 139 (30), 10294-10301, 2017 | 368 | 2017 |
| Machine learning the quantum-chemical properties of metal–organic frameworks for accelerated materials discovery AS Rosen, SM Iyer, D Ray, Z Yao, A Aspuru-Guzik, L Gagliardi, ... Matter 4 (5), 1578-1597, 2021 | 335 | 2021 |
| A porous, electrically conductive hexa-zirconium (IV) metal–organic framework S Goswami, D Ray, K Otake, CW Kung, SJ Garibay, T Islamoglu, A Atilgan, ... Chemical science 9 (19), 4477-4482, 2018 | 182 | 2018 |
| From Transition Metals to Lanthanides to Actinides: Metal-Mediated Tuning of Electronic Properties of Isostructural Metal–Organic Frameworks T Islamoglu, D Ray, P Li, MB Majewski, I Akpinar, X Zhang, CJ Cramer, ... Inorganic chemistry 57 (21), 13246-13251, 2018 | 111 | 2018 |
| Tuning Catalytic Sites on Zr6O8 Metal–Organic Framework Nodes via Ligand and Defect Chemistry Probed with tert-Butyl Alcohol Dehydration to Isobutylene D Yang, CA Gaggioli, D Ray, M Babucci, L Gagliardi, BC Gates Journal of the American Chemical Society 142 (17), 8044-8056, 2020 | 104 | 2020 |
| Computational Study of Structural and Electronic Properties of Lead-Free CsMI3 Perovskites (M = Ge, Sn, Pb, Mg, Ca, Sr, and Ba) D Ray, C Clark, HQ Pham, J Borycz, RJ Holmes, ES Aydil, L Gagliardi The Journal of Physical Chemistry C 122 (14), 7838-7848, 2018 | 93 | 2018 |
| Elucidating bonding preferences in tetrakis(imido)uranate(VI) dianions NH Anderson, J Xie, D Ray, M Zeller, L Gagliardi, SC Bart Nature Chemistry 9 (9), 850-855, 2017 | 67 | 2017 |
| Insights into the structure–activity relationships in metal–organic framework-supported nickel catalysts for ethylene hydrogenation X Wang, X Zhang, R Pandharkar, J Lyu, D Ray, Y Yang, S Kato, J Liu, ... ACS Catalysis 10 (16), 8995-9005, 2020 | 53 | 2020 |
| Photocatalytic Biocidal Coatings Featuring Zr6Ti4-Based Metal–Organic Frameworks X Wang, K Ma, T Goh, MR Mian, H Xie, H Mao, J Duan, KO Kirlikovali, ... Journal of the American Chemical Society 144 (27), 12192-12201, 2022 | 52 | 2022 |
| Advancement of actinide metal–organic framework chemistry via synthesis of Pu-UiO-66 AM Hastings, D Ray, WS Jeong, L Gagliardi, OK Farha, AE Hixon Journal of the American Chemical Society 142 (20), 9363-9371, 2020 | 51 | 2020 |
| In situ formation of unprecedented neptunium-oxide wheel clusters stabilized in a metal–organic framework SE Gilson, P Li, JES Szymanowski, J White, D Ray, L Gagliardi, OK Farha, ... Journal of the American Chemical Society 141 (30), 11842-11846, 2019 | 50 | 2019 |
| Metal–Organic Frameworks with Metal–Catecholates for O2/N2 Separation H Demir, SJ Stoneburner, WS Jeong, D Ray, X Zhang, OK Farha, ... The Journal of Physical Chemistry C 123 (20), 12935-12946, 2019 | 42 | 2019 |
| Precise control of Cu nanoparticle size and catalytic activity through pore templating in Zr metal–organic frameworks MR Mian, LR Redfern, SM Pratik, D Ray, J Liu, KB Idrees, T Islamoglu, ... Chemistry of Materials 32 (7), 3078-3086, 2020 | 33 | 2020 |
| Sulfur Vacancy Clustering and Its Impact on Electronic Properties in Pyrite FeS2 D Ray, B Voigt, M Manno, C Leighton, ES Aydil, L Gagliardi Chemistry of Materials 32 (11), 4820-4831, 2020 | 31 | 2020 |
| Tuning the conductivity of hexa-zirconium (IV) metal–organic frameworks by encapsulating heterofullerenes D Ray, S Goswami, J Duan, JT Hupp, CJ Cramer, L Gagliardi Chemistry of Materials 33 (4), 1182-1189, 2021 | 28 | 2021 |
| Cu[Ni(2,3-pyrazinedithiolate)2] Metal–Organic Framework for Electrocatalytic Hydrogen Evolution K Chen, D Ray, ME Ziebel, CA Gaggioli, L Gagliardi, SC Marinescu ACS Applied Materials & Interfaces 13 (29), 34419-34427, 2021 | 27 | 2021 |
| Using redox-active ligands to generate actinide Ligand radical species SS Galley, SA Pattenaude, D Ray, CA Gaggioli, MA Whitefoot, Y Qiao, ... Inorganic Chemistry 60 (20), 15242-15252, 2021 | 25 | 2021 |
| Exploring the effects of node topology, connectivity, and metal identity on the binding of nerve agents and their hydrolysis products in metal–organic frameworks ML Mendonca, D Ray, CJ Cramer, RQ Snurr ACS applied materials & interfaces 12 (31), 35657-35675, 2020 | 25 | 2020 |
| Discovery of spontaneous de-interpenetration through charged point-point repulsions SL Hanna, S Chheda, R Anderson, D Ray, CD Malliakas, JG Knapp, ... Chem 8 (1), 225-242, 2022 | 19 | 2022 |
| Leveraging Nitrogen Linkages in the Formation of a Porous Thorium–Organic Nanotube Suitable for Iodine Capture AM Hastings, D Ray, SL Hanna, WS Jeong, Z Chen, AG Oliver, ... Inorganic chemistry 61 (25), 9480-9492, 2022 | 18 | 2022 |