A DFT Investigation on the Electronic Structures and Au Adatom Assisted Hydrogenation of Graphene Nanoflake Array

作     者：SONG Yang TAO Lei ZHANG Yanfang PAN Jinbo DU Shixuan SONG Yang;TAO Lei;ZHANG Yanfang;PAN Jinbo;DU Shixuan

作者机构：Institute of Physics and School of Physical SciencesUniversity of Chinese Academy of SciencesChinese Academy of SciencesBeijing100190P.R.China Beijing National Laboratory for Condensed Matter PhysicsInstitute of Physics of Chinese Academy of SciencesBeijing100190P.R.China CAS Center for Excellence in Topological Quantum ComputationBeijing100190P.R.China Songshan Lake Materials LaboratoryDongguan523808P.R.China 

出 版 物：《Chemical Research in Chinese Universities》 (高等学校化学研究（英文版）)

年 卷 期：2021年第37卷第5期

页      面：1110-1115页

核心收录：

学科分类：081704[工学-应用化学] 07[理学] 08[工学] 0817[工学-化学工程与技术] 0703[理学-化学] 070301[理学-无机化学] 

基　　金：This work was supported by the National Natural Science Foundation of China(No.61888102) the National Key Research and Development Projects of China(Nos.2016YFA0202300,2018YFA0305800) the Strategic Priority Research Program of the Chinese Academy of Sciences,China(No.XDB30000000) 

主　　题：polarized Hydrogenation states 

摘      要：Graphene nanoribbons with zigzag edges(ZGNRs)have attracted much attention for their spin-polarized edge states predicted more than 15 years *** the ZGNRs are fabricated on metal substrates using molecular precursors,due to their strong coupling with metal substrates,experimental detection of the spin-polarized edge states is still ***,we design a partially hydrogenated graphene(PHGr).