Solving the electronic structure problem with machine learning A Chandrasekaran, D Kamal, R Batra, C Kim, L Chen, R Ramprasad npj Computational Materials 5 (1), 22, 2019 | 259 | 2019 |
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 | 229 | 2017 |
Flexible temperature‐invariant polymer dielectrics with large bandgap C Wu, AA Deshmukh, Z Li, L Chen, A Alamri, Y Wang, R Ramprasad, ... Advanced Materials 32 (21), 2000499, 2020 | 185 | 2020 |
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 | 181 | 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 | 165 | 2021 |
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), 2020 | 163 | 2020 |
Electrochemical stability window of polymeric electrolytes L Chen, S Venkatram, C Kim, R Batra, A Chandrasekaran, R Ramprasad Chemistry of Materials 31 (12), 4598-4604, 2019 | 118 | 2019 |
Hydroxyapatite substituted by transition metals: experiment and theory ME Zilm, L Chen, V Sharma, A McDannald, M Jain, R Ramprasad, M Wei Physical Chemistry Chemical Physics 18 (24), 16457-16465, 2016 | 117 | 2016 |
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 | 116 | 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 | 111 | 2020 |
Flexible polyolefin dielectric by strategic design of organic modules for harsh condition electrification AA Deshmukh, C Wu, O Yassin, A Mishra, L Chen, A Alamri, Z Li, J Zhou, ... Energy & Environmental Science 15 (3), 1307-1314, 2022 | 76 | 2022 |
Polymer informatics with multi-task learning C Kuenneth, AC Rajan, H Tran, L Chen, C Kim, R Ramprasad Patterns 2 (4), 2021 | 72 | 2021 |
Electronic structure of polyethylene: Role of chemical, morphological and interfacial complexity L Chen, TD Huan, R Ramprasad Scientific Reports 7 (1), 6128, 2017 | 72 | 2017 |
Charge injection barriers at metal/polyethylene interfaces L Chen, TD Huan, YC Quintero, R Ramprasad Journal of materials science 51, 506-512, 2016 | 72 | 2016 |
Polymers for extreme conditions designed using syntax-directed variational autoencoders R Batra, H Dai, TD Huan, L Chen, C Kim, WR Gutekunst, L Song, ... Chemistry of Materials 32 (24), 10489-10500, 2020 | 61 | 2020 |
General atomic neighborhood fingerprint for machine learning-based methods R Batra, HD Tran, C Kim, J Chapman, L Chen, A Chandrasekaran, ... The Journal of Physical Chemistry C 123 (25), 15859-15866, 2019 | 47 | 2019 |
Predicting crystallization tendency of polymers using multifidelity information fusion and machine learning S Venkatram, R Batra, L Chen, C Kim, M Shelton, R Ramprasad The Journal of Physical Chemistry B 124 (28), 6046-6054, 2020 | 42 | 2020 |
Improving the rotational freedom of polyetherimide: enhancement of the dielectric properties of a commodity high-temperature polymer using a structural defect A Alamri, C Wu, A Mishra, L Chen, Z Li, A Deshmukh, J Zhou, O Yassin, ... Chemistry of Materials 34 (14), 6553-6558, 2022 | 36 | 2022 |
Tuning surface states of metal/polymer contacts toward highly insulating polymer-based dielectrics Y Wang, S Nasreen, D Kamal, Z Li, C Wu, J Huo, L Chen, R Ramprasad, ... ACS Applied Materials & Interfaces 13 (38), 46142-46150, 2021 | 36 | 2021 |
Electronic structure of polymer dielectrics: the role of chemical and morphological complexity L Chen, R Batra, R Ranganathan, G Sotzing, Y Cao, R Ramprasad Chemistry of Materials 30 (21), 7699-7706, 2018 | 35 | 2018 |