| Pathways towards ferroelectricity in hafnia TD Huan, V Sharma, GA Rossetti Jr, R Ramprasad Physical Review B 90 (6), 064111, 2014 | 491 | 2014 |
| Mesoporous MoO3–x Material as an Efficient Electrocatalyst for Hydrogen Evolution Reactions Z Luo, R Miao, TD Huan, IM Mosa, AS Poyraz, W Zhong, JE Cloud, ... Advanced Energy Materials 6 (16), 1600528, 2016 | 457 | 2016 |
| Polymer Genome: A Data-Powered Polymer Informatics Platform for Property Predictions C Kim, A Chandrasekaran, TD Huan, D Das, R Ramprasad The Journal of Physical Chemistry C 122 (31), 17575-17585, 2018 | 415 | 2018 |
| Advanced polymeric dielectrics for high energy density applications TD Huan, S Boggs, G Teyssedre, C Laurent, M Cakmak, S Kumar, ... Progress in Materials Science 83, 236-269, 2016 | 379 | 2016 |
| Machine Learning Strategy for Accelerated Design of Polymer Dielectrics A Mannodi-Kanakkithodi, G Pilania, TD Huan, T Lookman, R Ramprasad Scientific Reports 6, 20952, 2016 | 377 | 2016 |
| A universal strategy for the creation of machine learning-based atomistic force fields TD Huan, R Batra, J Chapman, S Krishnan, L Chen, R Ramprasad npj Computational Materials 3 (1), 37, 2017 | 243 | 2017 |
| Polymer informatics: Current status and critical next steps L Chen, G Pilania, R Batra, TD Huan, C Kim, C Kuenneth, R Ramprasad Materials Science and Engineering: R: Reports 144, 100595, 2021 | 221 | 2021 |
| Polymer design using genetic algorithm and machine learning C Kim, R Batra, L Chen, H Tran, R Ramprasad Computational Materials Science 186, 110067, 2021 | 206 | 2021 |
| A hybrid organic-inorganic perovskite dataset C Kim, TD Huan, S Krishnan, R Ramprasad Scientific Data 4, 170057, 2017 | 206 | 2017 |
| Machine-learning predictions of polymer properties with Polymer Genome H Doan Tran, C Kim, L Chen, A Chandrasekaran, R Batra, S Venkatram, ... Journal of Applied Physics 128 (17), 171104, 2020 | 204 | 2020 |
| Factors Favoring Ferroelectricity in Hafnia: A First-Principles Computational Study R Batra, TD Huan, JL Jones, G Rossetti Jr, R Ramprasad The Journal of Physical Chemistry C 121 (8), 4139-4145, 2017 | 203 | 2017 |
| Scoping the polymer genome: A roadmap for rational polymer dielectrics design and beyond A Mannodi-Kanakkithodi, A Chandrasekaran, C Kim, TD Huan, G Pilania, ... Materials Today 21 (7), 785-796, 2018 | 201 | 2018 |
| A polymer dataset for accelerated property prediction and design TD Huan, A Mannodi-Kanakkithodi, C Kim, V Sharma, G Pilania, ... Scientific Data 3, 160012, 2016 | 200 | 2016 |
| Dopants promoting ferroelectricity in Hafnia: Insights from A comprehensive chemical space exploration R Batra, TD Huan, GA Rossetti, R Ramprasad Chemistry of Materials, 2017 | 196 | 2017 |
| Rational Co‐Design of Polymer Dielectrics for Energy Storage A Mannodi‐Kanakkithodi, GM Treich, TD Huan, R Ma, M Tefferi, Y Cao, ... Advanced Materials 28 (30), 6277-6291, 2016 | 192 | 2016 |
| Accelerated materials property predictions and design using motif-based fingerprints TD Huan, A Mannodi-Kanakkithodi, R Ramprasad Physical Review B 92 (01), 014106, 2015 | 192 | 2015 |
| Stabilization of metastable phases in hafnia owing to surface energy effects R Batra, HD Tran, R Ramprasad Applied Physics Letters 108 (17), 172902, 2016 | 158 | 2016 |
| Activating low-temperature diesel oxidation by single-atom Pt on TiO 2 nanowire array S Hoang, Y Guo, AJ Binder, W Tang, S Wang, JJ Liu, H Tran, X Lu, ... Nature Communications 11 (1), 1-10, 2020 | 141 | 2020 |
| Machine Learning Models for the Lattice Thermal Conductivity Prediction of Inorganic Materials L Chen, H Tran, R Batra, C Kim, R Ramprasad Computational Materials Science 170, 109155, 2019 | 132 | 2019 |
| Frequency-dependent dielectric constant prediction of polymers using machine learning L Chen, C Kim, R Batra, JP Lightstone, C Wu, Z Li, AA Deshmukh, ... npj Computational Materials 6 (1), 61, 2020 | 130 | 2020 |
