A systematic computational investigation of lithiation-induced structural phase transitions of O-functionalized MXenes
Qianku Hu, Yuhuan Ji, Dandan Li, Zhe Wang, Kun Han, Qinghua Wu, Junkai Wang, Qixun Xia, Libo Wang, Aiguo Zhou
Abstract
Lithiation-induced phase transitions of MXenes can be divided into three types, which are dependent on the sizes of M ions.
Topics & Concepts
MXenesMAX phasesPhase (matter)Materials scienceNanotechnologyComputational chemistryChemistryOrganic chemistryMXene and MAX Phase MaterialsAdvanced Memory and Neural ComputingFerroelectric and Negative Capacitance Devices