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author:

Wang, J. (Wang, J..) [1] | Li, C. (Li, C..) [2] | Guo, C. (Guo, C..) [3] | Du, Z. (Du, Z..) [4] | Wu, B. (Wu, B..) [5]

Indexed by:

Scopus

Abstract:

Based on the available experimental data, the Bi-Er and the Bi-Dy binary systems have been assessed thermodynamically using the CALPHAD (CALculaton of PHAse Diagram) technique. The formation enthalpies at 0 K of the compounds, Bi3Er5, BiEr, Bi3Dy5 and BiDy, were calculated by the first-principles method and Birch-Murnaghan equation of state, and the calculated results were used in the present thermodynamic optimization. All these compounds in the Bi-Er and the Bi-Dy systems were treated as stoichiometric compounds. The liquid phase was modeled as a substitutional solution phase based on random mixing of the constituent atoms and the excess Gibbs energy was formulated with the Redlich-Kister polynomial. Good agreements were obtained between the calculated results and the experimental data for both the thermochemical properties and the phase equilibrium relations. © 2013 Elsevier B.V. All rights reserved.

Keyword:

CALPHAD; First-principles calculations; Phase diagram; The Bi-Dy system; The Bi-Er system

Community:

  • [ 1 ] [Wang, J.]School of Materials Science and Engineering, University of Science and Technology Beijing, Beijing 100083, China
  • [ 2 ] [Li, C.]School of Materials Science and Engineering, University of Science and Technology Beijing, Beijing 100083, China
  • [ 3 ] [Guo, C.]School of Materials Science and Engineering, University of Science and Technology Beijing, Beijing 100083, China
  • [ 4 ] [Du, Z.]School of Materials Science and Engineering, University of Science and Technology Beijing, Beijing 100083, China
  • [ 5 ] [Wu, B.]School of Materials Science and Engineering, Fuzhou University, Fuzhou 350100, China

Reprint 's Address:

  • [Li, C.]School of Materials Science and Engineering, University of Science and Technology Beijing, Beijing 100083, China

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Source :

Thermochimica Acta

ISSN: 0040-6031

Year: 2013

Volume: 566

Page: 44-49

2 . 1 0 5

JCR@2013

3 . 1 0 0

JCR@2023

JCR Journal Grade:2

CAS Journal Grade:4

Cited Count:

WoS CC Cited Count:

SCOPUS Cited Count: 10

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 0

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