First-principles calculations of the CaF₂ bulk and surface electronic structure

Physics

• Electronic Structure 100%
• Density Functional Theory 100%
• First Principle 100%
• Density Functional Theory 50%
• Gaussian Distribution 50%
• Surface Energy 50%
• Generalized Gradient Approximation 50%
• Local Density Approximation 50%

Engineering

• Functionals 100%
• Energy Surface 50%
• Gaussians 50%
• Energy Gap 50%
• Generalized Gradient Approximation 50%
• Combined Method 50%
• Local Density Approximation 50%
• Kohn-Sham Equation 50%

Material Science

• Density 100%
• Electronic Structure 100%
• Surface Energy 20%