Electronic structure modeling of metal–organic frameworks JL Mancuso, AM Mroz, KN Le, CH Hendon Chemical reviews 120 (16), 8641-8715, 2020 | 196 | 2020 |
Soft mode metal-linker dynamics in carboxylate MOFs evidenced by variable-temperature infrared spectroscopy AB Andreeva, KN Le, L Chen, ME Kellman, CH Hendon, CK Brozek Journal of the American Chemical Society 142 (45), 19291-19299, 2020 | 57 | 2020 |
Determining optical band gaps of MOFs K Fabrizio, KN Le, AB Andreeva, CH Hendon, CK Brozek ACS Materials Letters 4 (3), 457-463, 2022 | 32 | 2022 |
Porous lanthanide metal–organic frameworks with metallic conductivity G Skorupskii, KN Le, DLM Cordova, L Yang, T Chen, CH Hendon, ... Proceedings of the National Academy of Sciences 119 (34), e2205127119, 2022 | 27 | 2022 |
Cooperativity and Metal–Linker Dynamics in Spin Crossover Framework Fe(1,2,3-triazolate)2 AB Andreeva, KN Le, K Kadota, S Horike, CH Hendon, CK Brozek Chemistry of Materials 33 (21), 8534-8545, 2021 | 19 | 2021 |
Multifactor theoretical modeling of solar thermal fuels built on azobenzene and norbornadiene scaffolds R Szabo, KN Le, T Kowalczyk Sustainable Energy & Fuels 5 (8), 2335-2346, 2021 | 15 | 2021 |
Time-Resolved in Situ Polymorphic Transformation from One 12-Connected Zr-MOF to Another SJ Lee, JL Mancuso, KN Le, CD Malliakas, YS Bae, CH Hendon, ... ACS Materials Letters 2 (5), 499-504, 2020 | 15 | 2020 |
Electronic challenges of retrofitting 2D electrically conductive MOFs to form 3D conductive lattices KN Le, JL Mancuso, CH Hendon ACS Applied Electronic Materials 3 (5), 2017-2023, 2021 | 14 | 2021 |
Pressure-induced metallicity and piezoreductive transition of metal-centres in conductive 2-dimensional metal–organic frameworks KN Le, CH Hendon Physical Chemistry Chemical Physics 21 (46), 25773-25778, 2019 | 13 | 2019 |
Assembling Phenothiazine into a Porous Coordination Cage to Improve Its Photocatalytic Efficiency for Organic Transformations H Lin, Z Xiao, KN Le, T Yan, P Cai, Y Yang, GS Day, HF Drake, H Xie, ... Angewandte Chemie International Edition 61 (49), e202214055, 2022 | 12 | 2022 |
Self-consistent optimization of excited states within density-functional tight-binding T Kowalczyk, K Le, S Irle Journal of Chemical Theory and Computation 12 (1), 313-323, 2016 | 12 | 2016 |
Electrical conductivity through π–π stacking in a two‐dimensional porous gallium catecholate metal–organic framework G Skorupskii, G Chanteux, KN Le, I Stassen, CH Hendon, M Dincă Annals of the New York Academy of Sciences 1518 (1), 226-230, 2022 | 9 | 2022 |
Conductivity in Open-Framework Chalcogenides Tuned via Band Engineering and Redox Chemistry J McKenzie, KN Le, DJ Bardgett, KA Collins, T Ericson, MK Wojnar, ... Chemistry of Materials 34 (4), 1905-1920, 2022 | 7 | 2022 |
Ligand-Engineered Spin Crossover in Fe (II)-Based Molecular and Metal–Organic Framework Systems MC Demuth, KN Le, M Sciprint, CH Hendon The Journal of Physical Chemistry C 127 (5), 2735-2740, 2023 | 5 | 2023 |
First Principles Studies of the Metal-Organic Interface in Porous Frameworks KN Le University of Oregon, 2022 | | 2022 |
Soft Mode Metal-Linker Dynamics in Carboxylate MOFs A Andreeva, L Chen, KN Le, ME Kellman, CH Hendon, C Brozek | | 2020 |
Porous lanthanide metal-organic frameworks with metallic conductivity G. Skorupskii1, K. Le2, DLM Cordova3, L. Yang1, T. Chen1, CH Hendon2, MQ Arguilla3, M. Dincă1 G Skorupskii, K Le, DLM Cordova, L Yang, T Chen, CH Hendon, ... | | |