Zobrazeno 1 - 10
of 31
pro vyhledávání: '"D. Sendek"'
Autor:
Yinxing Ma, Jiayu Wan, Xin Xu, Austin D. Sendek, Sarah E. Holmes, Brandi Ransom, Zhelong Jiang, Pu Zhang, Xin Xiao, Wenbo Zhang, Rong Xu, Fang Liu, Yusheng Ye, Emma Kaeli, Evan J. Reed, William C. Chueh, Yi Cui
Publikováno v:
ACS Energy Letters. :2762-2771
Publikováno v:
Transition Metal Oxides for Electrochemical Energy Storage. :393-409
Autor:
Vincent Dufour-Décieux, Brandi Ransom, Austin D. Sendek, Rodrigo Freitas, Jose Blanchet, Evan J. Reed
Publikováno v:
Journal of chemical theory and computation.
We develop a method to construct temperature-dependent kinetic models of hydrocarbon pyrolysis, based on information from molecular dynamics (MD) simulations of pyrolyzing systems in the high-temperature regime. MD simulations are currently a key too
Publikováno v:
MRS Bulletin. 46:1116-1129
We have identified CrOF4 and NbFe3(PO4)6 as candidate cathodes with density functional theory (DFT) calculations which suggest a useful balance of low chemical expansion and gravimetric energy density. Low chemical expansion is a likely requirement f
Autor:
Austin D. Sendek, Brandi Ransom, Ekin D. Cubuk, Lenson A. Pellouchoud, Jagjit Nanda, Evan J. Reed
Publikováno v:
Advanced Energy Materials. 12:2200553
Autor:
Josh Buettner-Garrett, Yi Cui, Evan J. Reed, Evan R. Antoniuk, Brian E. Francisco, Austin D. Sendek, Ekin D. Cubuk, Brandi Ransom
Publikováno v:
ACS applied materialsinterfaces. 12(34)
We report a solid-state Li-ion electrolyte predicted to exhibit simultaneously fast ionic conductivity, wide electrochemical stability, low cost, and low mass density. We report exceptional density functional theory (DFT)-based room-temperature singl
Publikováno v:
Chemistry of Materials. 31:342-352
We discover many new crystalline solid materials with fast single crystal Li ion conductivity at room temperature, discovered through density functional theory simulations guided by machine learning-based methods. The discovery of new solid Li superi
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Autor:
Jin Xie, Austin D. Sendek, Ekin D. Cubuk, Xiaokun Zhang, Zhiyi Lu, Yongji Gong, Tong Wu, Feifei Shi, Wei Liu, Evan J. Reed, Yi Cui
Publikováno v:
ACS Nano. 11:7019-7027
A coated cathode material includes a cathode active material and an interfacial layer coating the cathode active material. The interfacial layer includes a lithium-containing fluoride which includes at least one additional metal different from lithiu
Publikováno v:
Energy & Environmental Science. 10:306-320
We present a new type of large-scale computational screening approach for identifying promising candidate materials for solid state electrolytes for lithium ion batteries that is capable of screening all known lithium containing solids. To be useful