Electron traps and energy storage: modeling a bright path to the future.

电子陷阱和能量存储 ： 为通往未来的光明道路建模。

• 发表时间: 2023 Dec 1
• 来源期刊: Acta Crystallogr B Struct Sci Cryst Eng Mater
• DOI: 10.1107/S205252062301003X
• PMID: 37991239
• 文章类型: Journal Article
• 作者列表: Moura RT

关键词: TDDFT; doped materials; electron trap; luminescence; lutetium oxide; solid state

Abstract

By employing time-dependent density functional theory for solid-state chemistry, the research presented by Andrii Shyichuk [Acta Cryst. (2023), B67, 437-449] significantly contributes to the understanding of electron/hole traps in doped materials.

摘要

通过将时间依赖性密度泛函理论用于固态化学，AndriiShyichuk提出的研究[ActaCryst。(2023),B67，10.1107/S2052520623007709]显着有助于理解掺杂材料中的电子/空穴陷阱。