Mg segregation at Al/Al3Sc heterophase interfaces on an atomic scale:: Experiments and computations -: art. no. 036101

被引:97
作者
Marquis, EA
Seidman, DN
Asta, M
Woodward, C
Ozolins, V
机构
[1] USAF, Res Lab, Mat & Mfg Directorate, Wright Patterson AFB, OH 45433 USA
[2] Northwestern Univ, Dept Mat Sci & Engn, Evanston, IL 60208 USA
[3] Univ Calif Los Angeles, Dept Mat Sci & Engn, Los Angeles, CA 90095 USA
关键词
D O I
10.1103/PhysRevLett.91.036101
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Microscopic factors governing solute partitioning in ternary two-phase Al-Sc-Mg alloys are investigated combining three-dimensional-atom-probe (3DAP) miscroscopy measurements with first-principles computations. 3DAP is employed to measure composition profiles with subnanometer-scale resolution, leading to the identification of a large enhancement of Mg solute at the coherent alpha-Al/Al3Sc (fcc/L1(2)) heterophase interface. First-principles calculations establish an equilibrium driving force for this interfacial segregation reflecting the nature of the interatomic interactions.
引用
收藏
页数:4
相关论文
共 22 条
[1]  
[Anonymous], ADV ALUMINUM ALLOYS
[2]   First-principles calculations of bulk and interfacial thermodynamic properties for fcc-based Al-Sc alloys [J].
Asta, M ;
Foiles, SM ;
Quong, AA .
PHYSICAL REVIEW B, 1998, 57 (18) :11265-11275
[3]   Structural, vibrational, and thermodynamic properties of Al-Sc alloys and intermetallic compounds [J].
Asta, M ;
Ozolins, V .
PHYSICAL REVIEW B, 2001, 64 (09)
[4]   EQUILIBRIUM SEGREGATION AND INTERFACIAL ENERGY IN MULTICOMPONENT SYSTEMS [J].
DREGIA, SA ;
WYNBLATT, P .
ACTA METALLURGICA ET MATERIALIA, 1991, 39 (05) :771-778
[5]   Impurity diffusion of scandium in aluminum [J].
Fujikawa, SI .
DEFECT AND DIFFUSION FORUM, 1997, 143 :115-120
[6]  
Hellman OC, 2000, MICROSC MICROANAL, V6, P437, DOI 10.1007/s100050010051
[7]   KINETICS OF PRECIPITATION IN AL-SC ALLOYS AND LOW-TEMPERATURE SOLID SOLUBILITY OF SCANDIUM IN ALUMINUM STUDIED BY ELECTRICAL-RESISTIVITY MEASUREMENTS [J].
JO, HH ;
FUJIKAWA, SI .
MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING, 1993, 171 (1-2) :151-161
[8]   ABSOLUTE ATOMIC-SCALE MEASUREMENTS OF THE GIBBSIAN INTERFACIAL EXCESS OF SOLUTE AT INTERNAL INTERFACES [J].
KRAKAUER, BW ;
SEIDMAN, DN .
PHYSICAL REVIEW B, 1993, 48 (09) :6724-6727
[9]   AB-INITIO MOLECULAR-DYNAMICS SIMULATION OF THE LIQUID-METAL AMORPHOUS-SEMICONDUCTOR TRANSITION IN GERMANIUM [J].
KRESSE, G ;
HAFNER, J .
PHYSICAL REVIEW B, 1994, 49 (20) :14251-14269
[10]   Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set [J].
Kresse, G ;
Furthmuller, J .
PHYSICAL REVIEW B, 1996, 54 (16) :11169-11186