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相图计算及其应用
  • ISSN号：1673-0224
  • 期刊名称：粉末冶金材料科学与工程
  • 时间：2012
  • 页码：1-9
  • 分类：TG139.6[金属学及工艺—合金;一般工业技术—材料科学与工程;金属学及工艺—金属学]
  • 作者机构：[1]中南大学,粉末冶金国家重点实验室,长沙410083
  • 相关基金：国家自然科学基金重点项目（50831007）,国家自然科学基金面上项目（51071179）
  • 相关项目：Al-Fe-Ni-Si四元系有序相的原子移动性和扩散生长模型
作者： 李一为|常可可|王培生|胡标|张利军|刘树红|杜勇|
关键词： 相图计算, 模型, 应用, CALPHAD, thermodynamic models, thermodynamic calculations, application
中文摘要：

综述相图计算方法的发展现状、相图热力学计算常用的相描述模型及常用的热力学计算软件,并以Cu–Fe–Mn和Fe–Mn–Ni体系为例重点介绍相图热力学计算在材料设计及制备中的应用。

英文摘要：

The current status of CALPHAD（Calculation of Phase Diagram） approach is described.The models used in thermodynamic calculations and the most widely used softwares are summarized.Two examples of Cu-Fe-Mn and Fe-Mn-Ni systems are presented to demonstrate the practical applications of CALPHAD approach in materials design and manufacture.

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Al-Fe-Ni-Si四元系有序相的原子移动性和扩散生长模型
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The quarternary Al-Fe-Ni-Si phase equilibria in Al-rich corner:experimetal measurement and thermodyn
Experimental investigation and thermodynamic modeling of the Mn-Ni-Si system
Atomic mobility, diffusivity and diffusion growth simulation for fcc Cu-Mn-Ni alloys
Diffusivities and Atomic Mobilities of Sn-Bi and Sn-Pb Melts
Diffusivities and atomic mobilities in fcc_A1 Ni-X (X = Ge, Ti and V) alloys
Interdiffusion and atomic mobility studies in Ni-rich fcc Ni-Al-Mn alloys
Determination of the Phase Equilibria in the Mn-Sn-Zn System at 500 degrees C
First-principles calculations of mechanical and thermodynamic properties of the Laves C-15-Mg2RE (RE
Phase Equilibria of the Al-V-RE (RE = Gd, Ho) Systems at 773 K (500 A degrees C)
反钙钛矿结构Fe3AlH的物理性能
Phase equilibria in the Al-Zr-Ce system at 773 K
Atomic mobilities and diffusivities in the fcc, L1(2) and B2 phases of the Ni-Al system
Structure and stability of Al-Fe-Zr-Ce cluster: density functional study
Thermodynamic Modeling of the Li-H and Ca-H Systems
First-principles calculations on the crystal, electronic structures and elastic properties of Ag-ric
Density-functional theory study of Al-n and Aln-1Mg (n=2-17) clusters
Effects of Sintering and Extrusion on the Microstructures and Mechanical Properties of a SiC/Al-Cu C
Elastic, phonon and thermodynamic properties of Mg-Ga compounds from first-principles calculations
First-principles investigations of elastic, electronic and thermodynamic properties of Al12X (X = Mo
The structural stability, elastic constants and electronic structure of Al-Sr intermetallics by firs
Phase stability of magnesium-rare earth binary systems from first-principles calculations
Assessment of Atomic Mobilities in fcc Al-Ag-Zn Alloys
Investigation of primary Al-3(Sc,Zr) particles in Al-Sc-Zr alloys
Simulation of the electron diffraction patterns from needle/rod-like precipitates in Al-Mg-Si alloys
Ab initio investigation of structural, electronic, mechanical, and thermodynamic properties of AlSc2
First-principles study on the crystal, electronic structure and mechanical properties of hexagonal A
Properties of hexagonal Al2Ge2RE (RE = Y, La, Ce, Nd, Eu, Gd, Tb, Yb and Lu): A first-principles stu
Ab initio study of AlCu2M (M = Sc, Ti and Cr) ternary compounds under pressures
Reassessment of the Mg-Ge binary system using CALPHAD supported by first-principles calculation
Al合金扩散系数及微结构演变的模拟
Effects of Fe and Nb content on microstructure and mechanical characteristics of biomedical Ti based
Phase equilibria of the Al-Pr-Zr ternary system at 773 K
PRECIPITATION SEQUENCE OF AN AGED Al-Mg-Si ALLOY
Er和Yb元素对二元Al-Mg合金位错分布组态的影响
Experimental Phase Diagram of the Al-Er-Zr Ternary System
Structural, electronic, elastic and thermodynamic properties of AlSi2RE (RE = La, Ce, Pr and Nd) fro
Phase Diagrams of the Ce-Si-Zr Ternary System at 773 and 1173 K
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Assessment of atomic mobilities of Al and Cu in fcc Al-Cu alloys
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Density functional study of 3d-transition metal aluminides
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Phase diagram of the Al-Dy-Zr ternary system at 773 K
First-principles investigation of the mechanical, electronic and thermophysical properties of Q-phas
A new approach to establish both stable and metastable phase equilibria for fcc ordered/disordered p
Experimental Investigation and Thermodynamic Assessment of the Hf-Mn System
Effects of pressure and vibration on the thermal decomposition of cubic Ti1-xAlxN, Ti1-xZrxN, and Zr
COMPUTATIONAL STUDY OF DIFFUSIVITIES IN DIAMOND Ge-Si ALLOYS
Experimental Investigation of the Al-Cr-Gd Ternary System at 773 K
THERMODYNAMIC MODELING OF THE Na-X (X = Si, Ag, Cu, Cr) SYSTEMS
Thermodynamic assessment of the Sn-Sr system supported by first-principles calculations
Diffusivities and atomic mobilities in Cu-rich fcc Al-Cu-Mn alloys
Thermodynamic modeling of the Ge-Sc system supported by key experiments and first-principles calcula
Structural, electronic, elastic and thermodynamic properties of CaAl2Zn2 compound under different pr
Thermodynamic description of the Mn-Si-Zn system
THERMODYNAMIC MODELING OF THE Sc-Zn SYSTEM COUPLED WITH FIRST-PRINCIPLES CALCULATION
The structural, electronic, elastic and optical properties of AlCu(Se1-xTex)(2) compounds from first
Atomic mobility and diffusivity of bcc_A2 phase in the Fe-X (X = Cu, Si, Zn) systems
Al—Li系统性质的第一原理计算
反钙钛矿结构Fe_3AlH的物理性能
期刊信息
  • 《粉末冶金材料科学与工程》
  • 北大核心期刊（2011版）
  • 主管单位:教育部
  • 主办单位:中南大学
  • 主编：黄伯云
  • 地址：长沙市麓山南路中南大学粉末冶金研究院
  • 邮编：410083
  • 邮箱：pmbjb@csu.edu.cn
  • 电话：0731-88877163
  • 国际标准刊号：ISSN：1673-0224
  • 国内统一刊号：ISSN：43-1448/TF
  • 邮发代号:42-321
  • 获奖情况:
  • 国内外数据库收录:
  • 荷兰文摘与引文数据库,美国工程索引,中国北大核心期刊（2011版）,中国北大核心期刊（2014版）
  • 被引量:3662