Exhaustive and informatics-aided search for fast Li-ion conductor with NASICON-type structure using material simulation and Bayesian optimization

Currently, NASICON-type LiZr2(PO4)3 (LZP)-related materials are attracting attention as solid electrolytes. There are experimental reports that Li-ion conductivity can be improved by doping a small amount of Ca or Y into stoichiometric LZP. In previous studies, doping with only one element having a...

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Bibliographic Details
Main Authors: Koki Nakano, Yusuke Noda, Naoto Tanibata, Hayami Takeda, Masanobu Nakayama, Ryo Kobayashi, Ichiro Takeuchi
Format: Article
Language:English
Published: AIP Publishing LLC 2020-04-01
Series:APL Materials
Online Access:http://dx.doi.org/10.1063/5.0007414