| Ag–Bi Charge Redistribution Creates Deep Traps in Defective Cs2AgBiBr6: Machine Learning Analysis of Density Functional Theory D Liu, CM Perez, AS Vasenko, OV Prezhdo The Journal of Physical Chemistry Letters 13 (16), 3645-3651, 2022 | 21 | 2022 |
| Excited-State Properties of Defected Halide Perovskite Quantum Dots: Insights from Computation CM Perez, D Ghosh, O Prezhdo, S Tretiak, AJ Neukirch The Journal of Physical Chemistry Letters 12 (3), 1005-1011, 2021 | 18 | 2021 |
| Pb dimerization greatly accelerates charge losses in MAPbI3: Time-domain ab initio analysis Z Zhang, L Qiao, C Mora-Perez, R Long, OV Prezhdo The Journal of Chemical Physics 152 (6), 2020 | 15 | 2020 |
| Unlocking the electronic genome of halogenobenzenes SR Jezowski, R Baer, S Monaco, CA Mora-Perez, B Schatschneider Physical Chemistry Chemical Physics 19 (5), 4093-4103, 2017 | 15 | 2017 |
| Point defects in two-dimensional ruddlesden–popper perovskites explored with ab initio calculations CM Perez, D Ghosh, O Prezhdo, W Nie, S Tretiak, A Neukirch The Journal of Physical Chemistry Letters 13 (23), 5213-5219, 2022 | 12 | 2022 |
| Breaking phonon bottlenecks through efficient auger processes in perovskite nanocrystals H Baker, CM Perez, C Sonnichsen, D Strandell, OV Prezhdo, ... ACS nano 17 (4), 3913-3920, 2023 | 10 | 2023 |
| Halide Vacancies Create No Charge Traps on Lead Halide Perovskite Surfaces but Can Generate Deep Traps in the Bulk J Ran, B Wang, Y Wu, D Liu, C Mora Perez, AS Vasenko, OV Prezhdo The Journal of Physical Chemistry Letters 14 (26), 6028-6036, 2023 | 9 | 2023 |
| Impact of composition engineering on charge carrier cooling in hybrid perovskites: computational insights D Ghosh, CM Perez, O Prezhdo, W Nie, S Tretiak, AJ Neukirch Journal of Materials Chemistry C 10 (25), 9563-9572, 2022 | 8 | 2022 |
| Controlling Charge Carrier Dynamics in Porphyrin Nanorings by Optically Active Templates S Mondal, U Chowdhury, S Dey, M Habib, C Mora Perez, T Frauenheim, ... The Journal of Physical Chemistry Letters 14 (50), 11384-11392, 2023 | 5 | 2023 |
| Ab initio quantum dynamics of plasmonic charge carriers W Li, T Xue, C Mora-Perez, OV Prezhdo Trends in Chemistry, 2023 | 5 | 2023 |
| Polymorphic Control of Solution-Processed Cu2SnS3 Films with Thiol–Amine Ink Formulation KM Koskela, C Mora Perez, DB Eremin, JM Evans, MJ Strumolo, ... Chemistry of Materials 34 (19), 8654-8663, 2022 | 5 | 2022 |
| Excitonic Quantum Coherence in Light Emission from CsPbBr3 Metal-Halide Perovskite Nanocrystals D Strandell, C Mora Perez, Y Wu, OV Prezhdo, P Kambhampati Nano Letters 24 (1), 61-66, 2023 | 4 | 2023 |
| Electronic property trends of single-component organic molecular crystals containing C, N, O, and H S Monaco, RP Baer, RP Giernacky, ME Villalba, TM Garcia, C Mora-Perez, ... Computational Materials Science 197, 110510, 2021 | 3 | 2021 |
| Breaking the Condon Approximation for Light Emission from Metal Halide Perovskite Nanocrystals D Strandell, Y Wu, C Mora-Perez, O Prezhdo, P Kambhampati The Journal of Physical Chemistry Letters 14 (50), 11281-11285, 2023 | 2 | 2023 |
| Phenol as a Tethering Group to Gold Surfaces: Stark Response and Comparison to Benzenethiol S Menachekanian, C Mora Perez, AK Pennathur, MJ Voegtle, D Blauth, ... The Journal of Physical Chemistry Letters 14 (37), 8353-8359, 2023 | 1 | 2023 |
| Formation of a P162– Ink from Elemental Red Phosphorus in a Thiol–Amine Mixture MJ Strumolo, DB Eremin, S Wang, C Mora Perez, OV Prezhdo, ... Inorganic Chemistry 62 (16), 6197-6201, 2023 | 1 | 2023 |
| A-Cation-Dependent Excited State Charge Carrier Dynamics in Vacancy-Ordered Halide Perovskites: Insights from Computational and Machine Learning Models PK Nayak, C Mora Perez, D Liu, OV Prezhdo, D Ghosh Chemistry of Materials, 2024 | | 2024 |
| Superior Phonon-Limited Exciton Mobility in Lead-Free Two-Dimensional Perovskites L Jin, C Mora Perez, Y Gao, K Ma, JY Park, S Li, P Guo, L Dou, O Prezhdo, ... Nano Letters, 2024 | | 2024 |
| Tunneling-Driven Marcus-Inverted Triplet Energy Transfer in a Two-Dimensional Perovskite A De, C Mora Perez, A Liang, K Wang, L Dou, O Prezhdo, L Huang Journal of the American Chemical Society, 2024 | | 2024 |
| Deciphering Perovskite Nanocrystals with Quantum Dynamics Simulations CA Mora Perez Los Alamos National Laboratory (LANL), Los Alamos, NM (United States), 2023 | | 2023 |
