| Literature DB >> 31332923 |
Bowen Li1, Liyan Xie2, Zhaowu Wang3, Shi Chen1, Hui Ren1, Yuliang Chen1, Chengming Wang2, Guobin Zhang1, Jun Jiang2, Chongwen Zou1.
Abstract
Charge doping is an effective way to induce the metal-insulator transition (MIT) in correlated materials for many important utilizations, which is however practically limited by problem of low stability. An electron-proton co-doping mechanism is used to achieve pronounced phase modulation of monoclinic vanadium dioxide (VO2 ) at room temperature. Using l-ascorbic acid (AA) solution to treat VO2 , the ionized AA- species donate electrons to the adsorbed VO2 surface. Charges then electrostatically attract surrounding protons to penetrate, and eventually results in stable hydrogen-doped metallic VO2 . The variations of electronic structures, especially the electron occupancy of V 3d/O 2p hybrid orbitals, were examined by synchrotron characterizations and first-principle theoretical simulations. The adsorbed molecules protect hydrogen dopants from escaping out of lattice and thereby stabilize the metallic phase for VO2 .Entities:
Keywords: first-principle simulations; hydrogenation; metal-insulator phase transition; synchrotron characterization
Year: 2019 PMID: 31332923 DOI: 10.1002/anie.201904148
Source DB: PubMed Journal: Angew Chem Int Ed Engl ISSN: 1433-7851 Impact factor: 15.336