A unified moment tensor potential for silicon, oxygen, and silica

Material Science

• Density 100%
• Oxide Compound 100%
• Silicon Dioxide 100%
• Silicon 100%
• Crystal Structure 100%
• Atomic Structure 100%
• Ab Initio Method 100%
• Point Defect 100%

Chemistry

• Silicon 100%
• Density Functional Theory 100%
• Dioxygen 100%
• Silicon Dioxide 100%
• Interatomic Potential 50%
• Calculation Method 50%
• Crystal Defect 50%
• Crystal Structure 50%
• Disordered Structure 50%
• Crystal Point Defect 50%
• Oxide 50%

Keyphrases

• Silica 100%
• Moment Tensor Potential 100%
• Si-SiO2 50%
• Systems-based 25%
• Oxides 25%
• Dynamic Features 25%
• Charge Transfer 25%
• Interatomic Interaction 25%
• Atomic Structure 25%
• Defected Ground Structure 25%
• Density Functional Calculations 25%
• Ab Initio Methods 25%
• Disordered Structure 25%
• Extended Defects 25%
• Static Features 25%
• Theoretical Research 25%
• Comprehensive Dataset 25%
• CRISTAL 25%
• Technological Importance 25%
• Machine Learning Potential 25%