• Complex
  • Title
  • Keyword
  • Abstract
  • Scholars
  • Journal
  • ISSN
  • Conference
成果搜索

author:

Li, Guorong (Li, Guorong.) [1] | Zou, Xiangda (Zou, Xiangda.) [2] | Wang, Qifan (Wang, Qifan.) [3] | Wang, Xin (Wang, Xin.) [4] | Tang, Zhongzhi (Tang, Zhongzhi.) [5] | Zhou, Yangjie (Zhou, Yangjie.) [6] | Tang, Dian (Tang, Dian.) [7]

Indexed by:

EI PKU CSCD

Abstract:

The first-principle method based on the density functional theory(DFT) was performed to investigate the crystal structural characteristics of highly Si-doped (Ru1-xSix)O2(x=0,0.125,0.25,0.375 and 0.5). The phase analysis of Si-doped RuO2 evidently proves that the high concentrated Si solid solutions are achieved by thermal decomposition with proper annealing process. The band structures show that the highly Si-doped RuO2 always maintains metallic nature. The density of states suggests that the electrical conductive-hosts originate from Ru-4d and O-2p electrons, along with small amount Si-3p electrons. The descending of electrical conductivity of Si-doped (Ru1-xSix)O2 abides by the single exponential attenuation trend with increasing Si doping. © All Right Reserved.

Keyword:

Catalysts Computer simulation Crystal structure Decomposition Density functional theory Electric conductivity Electronic structure Ruthenium compounds Silica Silicon

Community:

  • [ 1 ] [Li, Guorong]College of Materials Science and Engineering, Fuzhou University, Fuzhou; Fujian; 350108, China
  • [ 2 ] [Zou, Xiangda]College of Materials Science and Engineering, Fuzhou University, Fuzhou; Fujian; 350108, China
  • [ 3 ] [Wang, Qifan]College of Materials Science and Engineering, Fuzhou University, Fuzhou; Fujian; 350108, China
  • [ 4 ] [Wang, Xin]College of Materials Science and Engineering, Fuzhou University, Fuzhou; Fujian; 350108, China
  • [ 5 ] [Tang, Zhongzhi]Institute of Materials Research, Fuzhou University, Fuzhou; Fujian; 350216, China
  • [ 6 ] [Zhou, Yangjie]Institute of Materials Research, Fuzhou University, Fuzhou; Fujian; 350216, China
  • [ 7 ] [Zhou, Yangjie]Fujian Institute of Metallurgical Engineering, Fuzhou; Fujian; 350111, China
  • [ 8 ] [Tang, Dian]College of Materials Science and Engineering, Fuzhou University, Fuzhou; Fujian; 350108, China
  • [ 9 ] [Tang, Dian]Institute of Materials Research, Fuzhou University, Fuzhou; Fujian; 350216, China

Reprint 's Address:

  • [wang, xin]college of materials science and engineering, fuzhou university, fuzhou; fujian; 350108, china

Show more details

Related Keywords:

Source :

CIESC Journal

ISSN: 0438-1157

Year: 2018

Issue: 8

Volume: 69

Page: 3717-3723

Cited Count:

WoS CC Cited Count:

SCOPUS Cited Count:

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 3

Affiliated Colleges:

Online/Total:185/10069809
Address:FZU Library(No.2 Xuyuan Road, Fuzhou, Fujian, PRC Post Code:350116) Contact Us:0591-22865326
Copyright:FZU Library Technical Support:Beijing Aegean Software Co., Ltd. 闽ICP备05005463号-1