First-principles study of binary bcc alloys using special quasirandom structures

INIS

• bcc lattices 100%
• alloys 60%
• solid solutions 30%
• relaxation 20%
• randomness 20%
• range 10%
• atoms 10%
• size 10%
• mimic 10%
• distribution 10%
• experimental data 10%
• equilibrium 10%
• correlation functions 10%
• magnetic moments 10%
• lattice parameters 10%
• bond lengths 10%
• formation enthalpy 10%

Chemistry

• Structure 70%
• Alloy 50%
• Solid Solution 30%
• First Principle 20%
• Phase Composition 20%
• Relaxation 20%
• Bond Length 10%
• Magnetic Moment 10%
• Lattice Parameter 10%
• Correlation Function 10%
• Enthalpy of Formation 10%
• Atom 10%
• Equilibrium 10%
• Particle Size 10%
• Substitutional Alloy 10%

Physics

• Alloy 50%
• Solid Solutions 30%
• First-Principles 20%
• Magnetic Moment 10%
• Lattice Parameter 10%
• Atoms 10%
• Behavior 10%
• Correlation 10%