Effect of lattice deformation on electronic and optical properties of CuGaSe₂: Ab-initio calculations

Compuestos químicos

• Ab Initio Calculation 56%
• Augmented Plane Wave Method 34%
• Band Gap 32%
• Chalcopyrite 26%
• Density Functional Theory 26%
• Electronic Band Structure 21%
• Electronic Property 53%
• Energy 20%
• Exchange-Correlation Potential 34%
• Modification 24%
• Optical Property 47%
• Optoelectronics 19%
• Refraction 27%
• Semiconductor 32%
• Strain 45%

Ingeniería y ciencia de los materiales

• Band structure 30%
• Density functional theory 64%
• Electronic properties 100%
• Energy gap 48%
• Materials science 26%
• Optical properties 80%
• Optoelectronic devices 25%
• Refraction 28%
• Semiconductor materials 38%

Física y astronomía

• approximation 16%
• axial strain 76%
• causes 19%
• density functional theory 49%
• electronics 33%
• energy 19%
• energy bands 30%
• gradients 21%
• materials science 35%
• optical properties 42%
• optimization 21%
• plane waves 26%
• refraction 29%