First-Principles Study of Electronic Structure of Type I Hybrid Carbon–Silicon Clathrates

Engineering & Materials Science

• Electronic structure 100%
• Atoms 69%
• Conduction bands 45%
• Alkaline earth metals 44%
• Energy gap 30%
• Carbon 20%
• Density functional theory 20%
• Computational methods 14%
• Substitution reactions 13%
• Silicon 10%
• Chemical analysis 8%
• Metals 8%

Physics & Astronomy

• clathrates 87%
• electronic structure 50%
• alkaline earth metals 37%
• atoms 34%
• conduction bands 23%
• carbon 17%
• hybrid structures 16%
• substitutes 10%
• density functional theory 10%
• silicon 7%
• electronics 6%
• metals 6%

Chemical Compounds

• Clathrate 75%
• Electronic State 49%
• Conduction Band 29%
• Alkaline Earth Metal 26%
• Band Gap 20%
• Density of State 14%
• Carbon Atom 12%
• Substitution Reaction 8%
• Density Functional Theory 8%
• Metal 6%