Publications

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2019

Ellis, Benjamin H., Michael Deceglie, and Anubhav Jain."Automatic Detection of Clear-Sky Periods From Irradiance Data."IEEE Journal of Photovoltaics 9.4 (2019) 998 - 1005. DOI
Ellis, Benjamin H., Michael Deceglie, and Anubhav Jain."Automatic Detection of Clear-Sky Periods From Irradiance Data."IEEE Journal of Photovoltaics 9.4 (2019) 998 - 1005. DOI
Liu, Haodong, Zhuoying Zhu, Jason Huang, Xin He, Yan Chen, Rui Zhang, Ruoqian Lin, Yejing Li, Sicen Yu, Xing Xing, Qizhang Yan, Xiangguo Li, Matthew J. Frost, Ke An, Jun Feng, Robert Kostecki, Huolin L. Xin, Shyue Ping Ong, and Ping Liu."Elucidating the Limit of Li Insertion into the Spinel Li 4Ti 5O 12."ACS Materials Letters 1.1 (2019) 96 - 102. DOI
Urban, Jeffrey J., Akanksha K. Menon, Zhiting Tian, Anubhav Jain, and Kedar Hippalgaonkar."New horizons in thermoelectric materials: Correlated electrons, organic transport, machine learning, and more."Journal of Applied Physics 125.18 (2019) 180902. DOI
Li, , Zeheng, Chen Fang, Chao Qian, Shudong Zhou, Xiangyun Song, Min Ling, Chengdu Liang, and Gao Liu."Polyisoprene Captured Sulfur Nanocomposite Materials for High-Areal-Capacity Lithium Sulfur Battery."ACS Applied Polymer Materials 1.8 (2019) 1965 - 1970. DOI
Lin, Ruoqian, Enyuan Hu, Mingjie Liu, Yi Wang, Hao Cheng, Jinpeng Wu, Jin-Cheng Zheng, Qin Wu, Seongmin Bak, Xiao Tong, Rui Zhang, Wanli Yang, Kristin A. Persson, Xiqian Yu, Xiao-Qing Yang, and Huolin L. Xin."Anomalous metal segregation in lithium-rich material provides design rules for stable cathode in lithium-ion battery."Nature Communications 10.1 (2019). DOI
Yourey, William, Yanbao Fu, Ning Li, Vincent S. Battaglia, and Wei Tong."Determining Accelerated Charging Procedure from Half Cell Characterization."Journal of The Electrochemical Society 166.8 (2019) A1432 - A1438. DOI
Seguin, Trevor J., Nathan T. Hahn, Kevin R. Zavadil, and Kristin A. Persson."Elucidating Non-aqueous Solvent Stability and Associated Decomposition Mechanisms for Mg Energy Storage Applications From First-PrinciplesTable."Frontiers in Chemistry 7 (2019). DOI
Xiao, , Haiqing, Tianyue Zheng, Gao Liu, Hongwei Wang, Hong Bai, Yanling Fu, Ziqiang Tao, Nianpeng Si, and Hua Bai."Study on the Fading Mechanism of SiO-based Anodes Using Styrene Butadiene Rubber and Carboxymethyl Cellulose as Binders for Lithium-ion Batteries."IOP Conference Series: Earth and Environmental Science 242 (2019) 042014. DOI
Lau, Ka-Cheong, Trevor J. Seguin, Emily V. Carino, Nathan T. Hahn, Justin G. Connell, Brian J. Ingram, Kristin A. Persson, Kevin R. Zavadil, and Chen Liao."Widening Electrochemical Window of Mg Salt by Weakly Coordinating Perfluoroalkoxyaluminate Anion for Mg Battery Electrolyte."Journal of The Electrochemical Society 166.8 (2019) A1510 - A1519. DOI
Vieten, Josua, Brendan Bulfin, Patrick Huck, Matthew Horton, Dorottya Guban, Liya Zhu, Youjun Lu, Kristin A. Persson, Martin Roeb, and Christian Sattler."Materials design of perovskite solid solutions for thermochemical applications."Energy & Environmental Science 12.4 (2019) 1369 - 1384. DOI
Dai, Kehua, Jinpeng Wu, Zengqing Zhuo, Qinghao Li, Shawn Sallis, Jing Mao, Guo Ai, Chihang Sun, Zaiyuan Li, William E. Gent, William C. Chueh, Yi-de Chuang, Rong Zeng, Zhi-xun Shen, Feng Pan, Shishen Yan, Louis F.J. Piper, Zahid Hussain, Gao Liu, and Wanli Yang."High Reversibility of Lattice Oxygen Redox Quantified by Direct Bulk Probes of Both Anionic and Cationic Redox Reactions."Joule 3.2 (2019) 518 - 541. DOI
Andersen, Amity, Nav Nidhi Rajput, Kee Sung Han, Huilin Pan, Niranjan Govind, Kristin A. Persson, Karl T. Mueller, and Vijayakumar Murugesan."Structure and Dynamics of Polysulfide Clusters in a Nonaqueous Solvent Mixture of 1,3-Dioxolane and 1,2-Dimethoxyethane."Chemistry of Materials 31.7 (2019) 2308 - 2319. DOI
Zhou, Jun, Lei Shen, Miguel Dias Costa, Kristin A. Persson, Shyue Ping Ong, Patrick Huck, Yunhao Lu, Xiaoyang Ma, Yiming Chen, Hanmei Tang, and Yuan Ping Feng."2DMatPedia, an open computational database of two-dimensional materials from top-down and bottom-up approaches."Scientific Data 6.1 (2019). DOI
Garten, Lauren M., David T. Moore, Sanjini U. Nanayakkara, Shyam S. Dwaraknath, Philip Schulz, Jake Wands, Angus Rockett, Brian Newell, Kristin A. Persson, Susan Trolier-McKinstry, and David S. Ginley."The existence and impact of persistent ferroelectric domains in MAPbI 3."Science Advances 5.1 (2019) eaas9311. DOI
Kuo, Jimmy Jiahong, Umut Aydemir, Jan-Hendrik Pöhls, Fei Zhou, Guodong Yu, Alireza Faghaninia, Francesco Ricci, Mary Anne White, Gian-Marco Rignanese, Geoffroy Hautier, Anubhav Jain, and G. Jeffrey Snyder."Origins of ultralow thermal conductivity in 1-2-1-4 quaternary selenides."Journal of Materials Chemistry A 7.6 (2019) 2589 - 2596. DOI
Singh, Arunima K., Joseph H. Montoya, John M. Gregoire, and Kristin A. Persson."Robust and synthesizable photocatalysts for CO2 reduction: a data-driven materials discovery."Nature Communications 10.1 (2019). DOI
Cao, Chuntian, Iwnetim Iwnetu Abate, Eric Sivonxay, Badri Shyam, Chunjing Jia, Brian Moritz, Thomas P. Devereaux, Kristin A. Persson, Hans-Georg Steinrück, and Michael F. Toney."Solid Electrolyte Interphase on Native Oxide-Terminated Silicon Anodes for Li-Ion Batteries."Joule 3.3 (2019) 762 - 781. DOI
Wang, Qi, and Anubhav Jain."A transferable machine-learning framework linking interstice distribution and plastic heterogeneity in metallic glasses."Nature Communications 10.1 (2019). DOI
Nanda, Jagjit, Guang Yang, Tingzheng Hou, Dmitry N. Voylov, Xin Li, Rose E. Ruther, Michael Naguib, Kristin A. Persson, Gabriel M. Veith, and Alexei P. Sokolov."Unraveling the Nanoscale Heterogeneity of Solid Electrolyte Interphase Using Tip-Enhanced Raman Spectroscopy."Joule (2019). DOI

2018

Zhao, Hui, Yang Wei, Cheng Wang, Ruimin Qiao, Wanli Yang, Phillip B. Messersmith, and Gao Liu."Mussel-Inspired Conductive Polymer Binder for Si-Alloy Anode in Lithium-Ion Batteries."ACS Applied Materials & Interfaces 10.6 (2018) 5440 - 5446. DOI
Bassman, Lindsay, Pankaj Rajak, Rajiv K. Kalia, Nakano Aiichiro, Sha Fei, Jifeng Sun, David J. Singh, Muratahan Aykol, Patrick Huck, Kristin A. Persson, and Priya Vashishta."Active learning for accelerated design of layered materials."npj Computational Materials 4.1 (2018). DOI
Gao, , Ximei, Guobin Zhu, Qunting Qu, Gao Liu, Vincent S. Battaglia, and Honghe Zheng."Effects of Room Ionic Liquid as Solute on the Electrolyte Solution Structure and Electrochemical Performances in Ethylene Carbonate-Based Electrolyte."Journal of The Electrochemical Society 165.16 (2018) A3844 - A3853. DOI
Shin, Yongwoo, Wang Hay Kan, Muratahan Aykol, Joseph K. Papp, Bryan D. McCloskey, Guoying Chen, and Kristin A. Persson."Alleviating oxygen evolution from Li-excess oxide materials through theory-guided surface protection."Nature Communications 9.1 (2018). DOI
Cheng, Lei, Miao Liu, Apurva Mehta, Huolin L. Xin, Feng Lin, Kristin A. Persson, Guoying Chen, Ethan J. Crumlin, and Marca M. Doeff."Garnet Electrolyte Surface Degradation and Recovery."ACS Applied Energy Materials 1.12 (2018) 7244 - 7252. DOI