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First-principles theory of 250 000-atom coherent alloy microstructure
C. Wolverton
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Corresponding author for this work
Materials Science and Engineering
Research output
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Contribution to journal
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Conference article
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peer-review
41
Scopus citations
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Keyphrases
Alloy Microstructure
100%
In Alloy
100%
First-principles Theory
100%
Monte Carlo Simulation
50%
Atomic Scale
50%
Microstructural
50%
First-principles
50%
Thermodynamics
50%
Coherent Precipitates
50%
Coherency Strain
50%
Solid Solution
50%
Al-Zn-Mg-Cu
50%
Precipitate Microstructure
50%
Aluminum Alloy
50%
System Size
50%
Reciprocal Space
50%
Al-Mg-Si
50%
Ising Model
50%
First-principles Electronic Structure Calculation
50%
Nanometre
50%
Total Energy Calculations
50%
Mg-Al
50%
Interfacial Free Energy
50%
Precipitate Shape
50%
Mixed Space
50%
Space Clusters
50%
Cluster-expansion Approach
50%
Coherent Precipitation
50%
Engineering
Anisotropic
100%
Length Scale
100%
Nanometre
100%
Size System
100%
Structure Calculation
100%
Famous Example
100%
Coherency Strain
100%
Ising Model
100%
Reciprocal Space
100%
Electronic State
100%
Solid Solutions
100%
Mg-Al Alloy
100%
Material Science
Electronic Structure Calculation
100%
Aluminum Alloy
100%
Solid Solutions
100%
Physics
First Principle
100%
Solid Solutions
33%
Statistical Thermodynamics
33%
Ising Model
33%
Monte Carlo Method
33%
Free Energy
33%