Atomistic level aqueous dissolution dynamics of NASICON-Type Li1+xAlxTi2-x(PO4)(3) (LATP)

  • Sengul, Mert Y.; 
  • Ndayishimiye, Arnaud; 
  • Lee, Wonho; 
  • Seo, Joo-Hwan; 
  • Fan, Zhongming; 
  • 외 4명
Citations

WEB OF SCIENCE

8

초록

Advancing the atomistic level understanding of aqueous dissolution of multicomponent materials is essential. We combined ReaxFF and experiments to investigate the dissolution at the Li1+xAlxTi2-x(PO4)(3)-water interface. We demonstrate that surface dissolution is a sequentially dynamic process. The phosphate dissolution destabilizes the NASICON structure, which triggers a titanium-rich secondary phase formation.

키워드

COLD SINTERING PROCESS; SOLID-ELECTROLYTE; REAXFF; FIELD
제목
Atomistic level aqueous dissolution dynamics of NASICON-Type Li1+xAlxTi2-x(PO4)(3) (LATP)
저자
Sengul, Mert Y.; Ndayishimiye, Arnaud; Lee, Wonho; Seo, Joo-Hwan; Fan, Zhongming; Shin, Yun Kyung; Gomez, Enrique D.; Randall, Clive A.; van Duin, Adri C. T.
DOI
10.1039/d1cp05360d
발행일
2022-02-16
유형
Article
저널명
Physical Chemistry Chemical Physics
권
24
호
7
페이지
4125 ~ 4130