Accelerated search for materials with targeted properties by adaptive design D Xue, PV Balachandran, J Hogden, J Theiler, D Xue, T Lookman
Nature communications 7 (1), 1-9, 2016
799 2016 Active learning in materials science with emphasis on adaptive sampling using uncertainties for targeted design T Lookman, PV Balachandran, D Xue, R Yuan
npj Computational Materials 5 (1), 21, 2019
459 2019 Accelerated Discovery of Large Electrostrains in BaTiO3 ‐Based Piezoelectrics Using Active Learning R Yuan, Z Liu, PV Balachandran, D Xue, Y Zhou, X Ding, J Sun, D Xue, ...
Advanced materials 30 (7), 1702884, 2018
361 2018 Experimental search for high-temperature ferroelectric perovskites guided by two-step machine learning PV Balachandran, B Kowalski, A Sehirlioglu, T Lookman
Nature communications 9 (1), 1668, 2018
271 2018 Adaptive strategies for materials design using uncertainties PV Balachandran, D Xue, J Theiler, J Hogden, T Lookman
Scientific reports 6 (1), 19660, 2016
250 2016 An informatics approach to transformation temperatures of NiTi-based shape memory alloys D Xue, D Xue, R Yuan, Y Zhou, PV Balachandran, X Ding, J Sun, ...
Acta Materialia 125, 532-541, 2017
231 2017 Predictions of new PV Balachandran, AA Emery, JE Gubernatis, T Lookman, C Wolverton, ...
Physical Review Materials 2 (4), 043802, 2018
209 2018 Finding new perovskite halides via machine learning G Pilania, PV Balachandran, C Kim, T Lookman
Frontiers in Materials 3, 19, 2016
195 2016 Chemical gradients in human enamel crystallites KA DeRocher, PJM Smeets, BH Goodge, MJ Zachman, PV Balachandran, ...
Nature 583 (7814), 66-71, 2020
183 2020 Multi-objective optimization for materials discovery via adaptive design AM Gopakumar, PV Balachandran, D Xue, JE Gubernatis, T Lookman
Scientific reports 8 (1), 3738, 2018
165 2018 Roadmap on machine learning in electronic structure HJ Kulik, T Hammerschmidt, J Schmidt, S Botti, MAL Marques, M Boley, ...
Electronic Structure 4 (2), 023004, 2022
150 2022 Effect of interfacial octahedral behavior in ultrathin manganite films EJ Moon, PV Balachandran, BJ Kirby, DJ Keavney, RJ Sichel-Tissot, ...
Nano letters 14 (5), 2509-2514, 2014
148 2014 Accelerated search for BaTiO3-based piezoelectrics with vertical morphotropic phase boundary using Bayesian learning D Xue, PV Balachandran, R Yuan, T Hu, X Qian, ER Dougherty, ...
Proceedings of the National Academy of Sciences 113 (47), 13301-13306, 2016
140 2016 Statistical inference and adaptive design for materials discovery T Lookman, PV Balachandran, D Xue, J Hogden, J Theiler
Current Opinion in Solid State and Materials Science 21 (3), 121-128, 2017
129 2017 Identifying the ‘inorganic gene’for high-temperature piezoelectric perovskites through statistical learning PV Balachandran, SR Broderick, K Rajan
Proceedings of the Royal Society A: Mathematical, Physical and Engineering …, 2011
115 2011 Interplay of octahedral rotations and breathing distortions in charge-ordering perovskite oxides PV Balachandran, JM Rondinelli
Physical Review B 88, 054101, 2013
109 2013 Three-dimensional imaging of vortex structure in a ferroelectric nanoparticle driven by an electric field D Karpov, Z Liu, TS Rolo, R Harder, PV Balachandran, D Xue, T Lookman, ...
Nature communications 8 (1), 280, 2017
101 2017 Polarization screening-induced magnetic phase gradients at complex oxide interfaces SR Spurgeon, PV Balachandran, DM Kepaptsoglou, AR Damodaran, ...
Nature communications 6 (1), 6735, 2015
91 2015 Learning from data to design functional materials without inversion symmetry PV Balachandran, J Young, T Lookman, JM Rondinelli
Nature communications 8 (1), 14282, 2017
90 2017 Materials prediction via classification learning PV Balachandran, J Theiler, JM Rondinelli, T Lookman
Scientific reports 5 (1), 13285, 2015
90 2015