• Complex
  • Title
  • Author
  • Keyword
  • Abstract
  • Scholars
Search

Author:

Li, Y. F. (Li, Y. F..) | Xiao, B. (Xiao, B..) | Sun, L. (Sun, L..) | Gao, Y. M. (Gao, Y. M..) | Ma, S. Q. (Ma, S. Q..) | Yi, D. W. (Yi, D. W..)

Indexed by:

SCIE EI Scopus

Abstract:

The mechanical, electronic and thermal physical properties of A-type R2O3 (R=Y, La) under hydrostatic pressure are studied by first-principles calculations. The calculated band gap is 6.3 eV (5.9 eV) for Y2O3 (La2O3). Under hydrostatic pressure, both phases show anisotropic elasticity in different crystallographic directions. The isothermal bulk modulus of R2O3 decreases monotonically with the increasing of temperature from 300 K to 1500 K. The intrinsic ductile nature of both phases is confirmed by the obtained B/G ratio. The temperature dependence of linear TECs of La2O3 is stronger than that of Y2O3, and the linear TECs in [001] direction show larger values in both phases than those in [010] direction. At room temperature, the average linear TECs for Y2O3 and La2O3 are 8.40x10(-6) K-1 and 8.42x10(-6) K-1, respectively. Other thermal physical properties such as specific heats (C-V, and C-P), entropy (S), sound velocity and Debye temperature are also obtained.

Keyword:

Anisotropy Elasticity Rare-earth sesquioxides Thermal expansion

Author Community:

  • [ 1 ] [Li, Y. F.; Sun, L.; Gao, Y. M.; Ma, S. Q.] Xi An Jiao Tong Univ, State Key Lab Mech Behav Mat, Xian 710049, Peoples R China
  • [ 2 ] [Xiao, B.] UCL, Dept Earth Sci, London WC1E 6BT, England
  • [ 3 ] [Yi, D. W.] Xian Univ Sci & Technol, Coll Mat Sci & Engn, Xian 710054, Peoples R China
  • [ 4 ] [Li, Y. F.]Xi An Jiao Tong Univ, State Key Lab Mech Behav Mat, Xian 710049, Peoples R China
  • [ 5 ] [Sun, L.]Xi An Jiao Tong Univ, State Key Lab Mech Behav Mat, Xian 710049, Peoples R China
  • [ 6 ] [Gao, Y. M.]Xi An Jiao Tong Univ, State Key Lab Mech Behav Mat, Xian 710049, Peoples R China
  • [ 7 ] [Ma, S. Q.]Xi An Jiao Tong Univ, State Key Lab Mech Behav Mat, Xian 710049, Peoples R China
  • [ 8 ] [Xiao, B.]UCL, Dept Earth Sci, London WC1E 6BT, England
  • [ 9 ] [Yi, D. W.]Xian Univ Sci & Technol, Coll Mat Sci & Engn, Xian 710054, Peoples R China

Reprint Author's Address:

  • Xi An Jiao Tong Univ, State Key Lab Mech Behav Mat, Xian 710049, Peoples R China.

Show more details

Related Keywords:

Source :

JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS

ISSN: 0022-3697

Year: 2017

Volume: 103

Page: 49-58

2 . 2 0 7

JCR@2017

3 . 9 9 5

JCR@2020

ESI Discipline: PHYSICS;

ESI HC Threshold:120

JCR Journal Grade:3

CAS Journal Grade:4

Cited Count:

WoS CC Cited Count: 5

SCOPUS Cited Count: 7

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 4

FAQ| About| Online/Total:847/199605504
Address:XI'AN JIAOTONG UNIVERSITY LIBRARY(No.28, Xianning West Road, Xi'an, Shaanxi Post Code:710049) Contact Us:029-82667865
Copyright:XI'AN JIAOTONG UNIVERSITY LIBRARY Technical Support:Beijing Aegean Software Co., Ltd.