Efficient calculation of carrier scattering rates from first principles von Ganose, Alex M., Park, Junsoo, Faghaninia, Alireza, Woods-Robinson, Rachel, Persson, Kristin A., Jain, Anubhav

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A transferable machine-learning framework linking interstice distribution and plastic heterogeneity in metallic glasses von Wang, Qi, Jain, Anubhav

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Benchmarking materials property prediction methods: the Matbench test set and Automatminer reference algorithm von Dunn, Alexander, Wang, Qi, Ganose, Alex, Dopp, Daniel, Jain, Anubhav

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When band convergence is not beneficial for thermoelectrics von Park, Junsoo, Dylla, Maxwell, Xia, Yi, Wood, Max, Snyder, G. Jeffrey, Jain, Anubhav

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Best practices in machine learning for chemistry von Artrith, Nongnuch, Butler, Keith T., Coudert, François-Xavier, Han, Seungwu, Isayev, Olexandr, Jain, Anubhav, Walsh, Aron

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Recent advances and applications of deep learning methods in materials science von Choudhary, Kamal, DeCost, Brian, Chen, Chi, Jain, Anubhav, Tavazza, Francesca, Cohn, Ryan, Park, Cheol Woo, Choudhary, Alok, Agrawal, Ankit, Billinge, Simon J. L., Holm, Elizabeth, Ong, Shyue Ping, Wolverton, Chris

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New opportunities for materials informatics: Resources and data mining techniques for uncovering hidden relationships von Jain, Anubhav, Hautier, Geoffroy, Ong, Shyue Ping, Persson, Kristin

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A framework for quantifying uncertainty in DFT energy corrections von Wang, Amanda, Kingsbury, Ryan, McDermott, Matthew, Horton, Matthew, Jain, Anubhav, Ong, Shyue Ping, Dwaraknath, Shyam, Persson, Kristin A.

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A critical examination of compound stability predictions from machine-learned formation energies von Bartel, Christopher J., Trewartha, Amalie, Wang, Qi, Dunn, Alexander, Jain, Anubhav, Ceder, Gerbrand

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New horizons in thermoelectric materials: Correlated electrons, organic transport, machine learning, and more von Urban, Jeffrey J., Menon, Akanksha K., Tian, Zhiting, Jain, Anubhav, Hippalgaonkar, Kedar

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Evaluation of Tavorite-Structured Cathode Materials for Lithium-Ion Batteries Using High-Throughput Computing von Mueller, Tim, Hautier, Geoffroy, Jain, Anubhav, Ceder, Gerbrand

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A simple model for the entropy of melting of monatomic liquids von Lilley, Drew, Jain, Anubhav, Prasher, Ravi

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Spinel compounds as multivalent battery cathodes: a systematic evaluation based on ab initio calculations von Liu, Miao, Rong, Ziqin, Malik, Rahul, Canepa, Pieremanuele, Jain, Anubhav, Ceder, Gerbrand, Persson, Kristin A

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Local structure order parameters and site fingerprints for quantification of coordination environment and crystal structure similarity von Zimmermann, Nils E. R., Jain, Anubhav

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Data Mined Ionic Substitutions for the Discovery of New Compounds von Hautier, Geoffroy, Fischer, Chris, Ehrlacher, Virginie, Jain, Anubhav, Ceder, Gerbrand

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Matminer: An open source toolkit for materials data mining von Ward, Logan, Dunn, Alexander, Faghaninia, Alireza, Zimmermann, Nils E.R., Bajaj, Saurabh, Wang, Qi, Montoya, Joseph, Chen, Jiming, Bystrom, Kyle, Dylla, Maxwell, Chard, Kyle, Asta, Mark, Persson, Kristin A., Snyder, G. Jeffrey, Foster, Ian, Jain, Anubhav

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Finding Nature’s Missing Ternary Oxide Compounds Using Machine Learning and Density Functional Theory von Hautier, Geoffroy, Fischer, Christopher C, Jain, Anubhav, Mueller, Tim, Ceder, Gerbrand

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An autonomous laboratory for the accelerated synthesis of novel materials von Szymanski, Nathan J., Rendy, Bernardus, Fei, Yuxing, Kumar, Rishi E., He, Tanjin, Milsted, David, McDermott, Matthew J., Gallant, Max, Cubuk, Ekin Dogus, Merchant, Amil, Kim, Haegyeom, Jain, Anubhav, Bartel, Christopher J., Persson, Kristin, Zeng, Yan, Ceder, Gerbrand

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A Statistical Learning Framework for Materials Science: Application to Elastic Moduli of k-nary Inorganic Polycrystalline Compounds von de Jong, Maarten, Chen, Wei, Notestine, Randy, Persson, Kristin, Ceder, Gerbrand, Jain, Anubhav, Asta, Mark, Gamst, Anthony

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Voltage, stability and diffusion barrier differences between sodium-ion and lithium-ion intercalation materials von Ong, Shyue Ping, Chevrier, Vincent L, Hautier, Geoffroy, Jain, Anubhav, Moore, Charles, Kim, Sangtae, Ma, Xiaohua, Ceder, Gerbrand

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