An introduction to the BFS method and its use to model binary NiAl alloys

被引：29

作者：

Bozzolo, G

Noebe, RD

Ferrante, J

Amador, C

机构：

[1] Ohio Aerosp Inst, Cleveland, OH 44142 USA

[2] NASA, Lewis Res Ctr, Cleveland, OH 44135 USA

[3] Cleveland State Univ, Dept Phys, Cleveland, OH 44115 USA

[4] Univ Nacl Autonoma Mexico, Fac Quim, Dept Fis & Quim Teor, Mexico City 04510, DF, Mexico

来源：

JOURNAL OF COMPUTER-AIDED MATERIALS DESIGN | 1999年 / 6卷 / 01期

关键词：

alloys; BFS method; defect structure; intermetallics; semiempirical methods;

D O I：

10.1023/A:1026403832705

中图分类号：

TP39 [计算机的应用];

学科分类号：

081203 ; 0835 ;

摘要：

We introduce the Bozzolo-Ferrante-Smith (BFS) method for alloys as a computationally efficient tool for aiding in the process of alloy design. An intuitive description of the BFS method is provided, followed by a formal discussion of its implementation. The method is applied to the study of the defect structure of NiAl binary alloys. The groundwork is laid for a detailed progression to higher order NiAl-based alloys linking theoretical calculations and computer simulations based on the BFS method and experimental work validating each step of the alloy design process.

引用

页码：1 / 32

页数：32

共 57 条

[1] Stability of Zr-Al alloys [J].