Analyzing and simulating of the structure of RuO2-SnO2 solid solution - Details

author：

Liu, X.-H. (Liu, X.-H..) ^[1] | Liu, Y.-R. (Liu, Y.-R..) ^[2] | Wang, X. (Wang, X..) ^[3] | Deng, F.-Y. (Deng, F.-Y..) ^[4] | Tang, D. (Tang, D..) ^[5]

Indexed by：

Scopus PKU CSCD

Abstract：

The　rutile　SnxRu1-xO2　(0≤x≤1)　structures　were　calculated　by　the　first-principles　on　density　functional　theory　(DFT)　and　optimized　by　local　density　approximation　(LDA).　The　changes　in　the　lattice　parameters　with　the　increase　of　tin　were　shown.　A　function　between　the　cell　volume(V)　and　the　solid　solubility(x)　could　be　fitted,　and　then　the　precise　researches　on　the　structures　of　SnxRu1-xO2　solid　solutions　could　be　realized,　which　are　in　good　agreement　with　the　practical　results.

Keyword：

DFT; First-principles; LDA; RuO2-SnO2 solid solution

Community：

[ 1 ] [Liu, X.-H.]College of Material Science and Engineering, Fuzhou University, Fuzhou 350108, China
[ 2 ] [Liu, Y.-R.]College of Material Science and Engineering, Fuzhou University, Fuzhou 350108, China
[ 3 ] [Wang, X.]College of Material Science and Engineering, Fuzhou University, Fuzhou 350108, China
[ 4 ] [Deng, F.-Y.]College of Material Science and Engineering, Fuzhou University, Fuzhou 350108, China
[ 5 ] [Tang, D.]College of Material Science and Engineering, Fuzhou University, Fuzhou 350108, China
[ 6 ] [Tang, D.]Institute for Materials Research, Fuzhou University, Fuzhou 350108, China

Reprint 's Address：

[Wang, X.]College of Material Science and Engineering, Fuzhou University, Fuzhou 350108, China

Email：

xinwx@163.com

Show more details

Related Keywords：

Source ：

Transactions of Materials and Heat Treatment

ISSN： 1009-6264

Year： 2013

Issue： SUPPL.2

Volume： 34

Page： 248-252

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： 1

Affiliated Colleges：

Get Fulltext

Library Discovery Baidu Scholar Search SCOPUS

Type
Departments

All Years Choose Year From to