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Fast kinetics of monoclinic VO2(B) bulk upon magnesiation via DFT+U calculations

Authors :
Danmei Gao
Jingren Dong
Renchao Xiao
Bo Shang
Danmei Yu
Changguo Chen
Yuping Liu
Kai Zheng
Fusheng Pan
Source :
Physical Chemistry Chemical Physics. 24:2150-2157
Publication Year :
2022
Publisher :
Royal Society of Chemistry (RSC), 2022.

Abstract

The Mg2+ diffusivity of 1.62 × 10āˆ’7 cm2 sāˆ’1 is comparable to that of Li+ at 300 K, demonstrating the high mobility and fast kinetics of VO2(B) as a potential host material.

Details

ISSN :
14639084 and 14639076
Volume :
24
Database :
OpenAIRE
Journal :
Physical Chemistry Chemical Physics
Accession number :
edsair.doi...........2da97054adf848023ffec9a6ca05f05b