Applied Energy Materials Group

2020

Smidt, Tess E, Stephanie A Mack, Sebastian E Reyes-Lillo, Anubhav Jain, and Jeffrey B Neaton. "An automatically curated first-principles database of ferroelectrics." Scientific Data 7.1 (2020).
He, Changfei, Peter R Christensen, Trevor J Seguin, Eric A Dailing, Brandon M Wood, Rebecca K Walde, Kristin A Persson, Thomas P Russell, and Brett A Helms. "Conformational Entropy as a Means to Control the Behavior of Poly(diketoenamine) Vitrimers In and Out of Equilibrium." Angewandte Chemie International Edition 59.2 (2020) 735 - 739.
Mao, Wenfeng, Wei Yue, Zijia Xu, Shiyong Chang, Qianqian Hu, Feng Pei, Xiangdong Huang, Jingbo Zhang, Dejun Li, Gao Liu, and Guo Ai. "Development of a Synergistic Activation Strategy for the Pilot-Scale Construction of Hierarchical Porous Graphitic Carbon for Energy Storage Applications." ACS Nano 14.4 (2020) 4741 - 4754.
Wu, Jinpeng, Zengqing Zhuo, Xiaohui Rong, Kehua Dai, Zachary Lebens-Higgins, Shawn Sallis, Feng Pan, Louis FJ Piper, Gao Liu, Yi- De Chuang, Zahid Hussain, Qinghao Li, Rong Zeng, Zhi-xun Shen, and Wanli Yang. "Dissociate lattice oxygen redox reactions from capacity and voltage drops of battery electrodes." Science Advances 6.6 (2020) eaaw3871.
Zhang, Guangzhao, Yu Yang, Tian Zhang, Dongwei Xu, Zhiwen Lei, Chaoyang Wang, Gao Liu, and Yonghong Deng. "FeIII chelated organic anode with ultrahigh rate performance and ultra-long cycling stability for lithium-ion batteries." Energy Storage Materials 24 (2020) 432 - 438.
Cooley, Joya A, Matthew K Horton, Emily E Levin, Saul H Lapidus, Kristin A Persson, and Ram Seshadri. "From Waste-Heat Recovery to Refrigeration: Compositional Tuning of Magnetocaloric Mn 1+ x Sb." Chemistry of Materials 32.3 (2020) 1243 - 1249.
Zheng, Hui, Xiang-Guo Li, Richard Tran, Chi Chen, Matthew Horton, Donald Winston, Kristin A Persson, and Shyue Ping Ong. "Grain boundary properties of elemental metals." Acta Materialia 186 (2020) 40 - 49.
Zimmermann, Nils ER, and Anubhav Jain. "Local structure order parameters and site fingerprints for quantification of coordination environment and crystal structure similarity." RSC Advances 10.10 (2020) 6063 - 6081.
Ling, Handong, Shyam S Dwaraknath, and Kristin A Persson. "Origin of Disorder Tolerance in Piezoelectric Materials and Design of Polar Systems." Chemistry of Materials 32.7 (2020) 2836 - 2842.
Mrdjenovich, David, Matthew K Horton, Joseph H Montoya, Christian M Legaspi, Shyam Dwaraknath, Vahe Tshitoyan, Anubhav Jain, and Kristin A Persson. "propnet: A Knowledge Graph for Materials Science." Matter 2.2 (2020) 464 - 480.
Jordan, Dirk C, Wei Luo, Anubhav Jain, Mashad U Saleh, Heidi von Korff, Yang Hu, Jean-Nicolas Jaubert, Fotis Mavromatakis, Chris Deline, Michael G Deceglie, Ambarish Nag, Gregory M Kimball, Adam B Shinn, Jim J John, Aaesha A Alnuaimi, and Ammar BA Elnosh. "Reducing Interanalyst Variability in Photovoltaic Degradation Rate Assessments." IEEE Journal of Photovoltaics 10.1 (2020) 206 - 212.
Wang, Hui, Xuefei Feng, Ying Chen, Yi-Sheng Liu, Kee Sung Han, Mingxia Zhou, Mark H Engelhard, Vijayakumar Murugesan, Rajeev S Assary, Tianbiao Leo Liu, Wesley Henderson, Zimin Nie, Meng Gu, Jie Xiao, Chongmin Wang, Kristin A Persson, Donghai Mei, Ji-Guang Zhang, Karl T Mueller, Jinghua Guo, Kevin Zavadil, Yuyan Shao, and Jun Liu. "Reversible Electrochemical Interface of Mg Metal and Conventional Electrolyte Enabled by Intermediate Adsorption." ACS Energy Letters 5.1 (2020) 200 - 206.
Gonze, Xavier, Bernard Amadon, Gabriel Antonius, Frédéric Arnardi, Lucas Baguet, Jean-Michel Beuken, Jordan Bieder, François Bottin, Johann Bouchet, Eric Bousquet, Nils Brouwer, Fabien Bruneval, Guillaume Brunin, Théo Cavignac, Jean-Baptiste Charraud, Wei Chen, Michel Côté, Stefaan Cottenier, Jules Denier, Grégory Geneste, Philippe Ghosez, Matteo Giantomassi, Yannick Gillet, Olivier Gingras, Donald R Hamann, Geoffroy Hautier, Xu He, Nicole Helbig, Natalie Holzwarth, Yongchao Jia, François Jollet, William Lafargue-Dit-Hauret, Kurt Lejaeghere, Miguel AL Marques, Alexandre Martin, Cyril Martins, Henrique PC Miranda, Francesco Naccarato, Kristin A Persson, Guido Petretto, Valentin Planes, Yann Pouillon, Sergei Prokhorenko, Fabio Ricci, Gian-Marco Rignanese, Aldo H Romero, Michael Marcus Schmitt, Marc Torrent, Michiel J van Setten, Benoit Van Troeye, Matthieu J Verstraete, Gilles Zérah, and Josef W Zwanziger. "The Abinitproject: Impact, environment and recent developments." Computer Physics Communications 248 (2020) 107042.
Zhou, Shuo, Chen Fang, Xiangyun Song, and Gao Liu. "The influence of compact and ordered carbon coating on solid‐state behaviors of silicon during electrochemical processes." Carbon Energy (2020).
Sivonxay, Eric, Muratahan Aykol, and Kristin A Persson. "The lithiation process and Li diffusion in amorphous." Electrochimica Acta 331 (2020) 135344.
Lin, Shuren, Zixuan Fang, Tingzheng Hou, Ting Wan Hsu, Chi H So, Cher Yeoh, Roger Li, Yin Liu, Emory M Chan, Yu-Lun Chueh, Bin Tang, Kristin A Persson, and Jie Yao. "Tunable valleytronics with symmetry-retaining high polarization degree in SnS x Se 1−x model system." Applied Physics Letters 116.6 (2020) 061105.
Borodin, Oleg, Julian Self, Kristin A Persson, Chunsheng Wang, and Kang Xu. "Uncharted Waters: Super-Concentrated Electrolytes." Joule 4.1 (2020) 69 - 100.
Woods-Robinson, Rachel, Yanbing Han, Hanyu Zhang, Tursun Ablekim, Imran Sheikh, Kristin A Persson, and Andriy Zakutayev. "Wide Band Gap Chalcogenide Semiconductors." Chemical Reviews (2020).

2019

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).
Stern, Rebecca D, Danielle C Hutchison, Morgan R Olsen, Lev N Zakharov, May Nyman, and Kristin A Persson. "Alkyltin Keggin clusters as EUVL photoresist technology." International Conference on Extreme Ultraviolet Lithography 2019International Conference on Extreme Ultraviolet Lithography 2019. Ed. Ronse, Kurt G, Paolo A Gargini, Patrick P Naulleau, and Toshiro Itani. Monterey, United States: SPIE, 2019.
Tran, Richard, Xiang-Guo Li, Joseph H Montoya, Donald Winston, Kristin A Persson, and Shyue Ping Ong. "Anisotropic work function of elemental crystals." Surface Science 687 (2019) 48 - 55.
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).
Zheng, Tianyue, Ting Zhang, Mauricio Solis de la Fuente, and Gao Liu. "Aqueous emulsion of conductive polymer binders for Si anode materials in lithium ion batteries." European Polymer Journal 114 (2019) 265 - 270.
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.
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.

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