Each sample groups how it was prepared, characterized, and measured. Click a card to expand.
7 × 7 × 1 hBN supercell used for point-defect calculations; relaxed unit cell used as the starting point, with a 15 Å vacuum layer and spin-polarized HSE06 DFT.
1 property
Simulated Supercell DfthBNStudied Material
Why these are connected
Related documents with shared materials, methods, properties, or citations.
Each sample groups how it was prepared, characterized, and measured. Click a card to expand.
7 × 7 × 1 hBN supercell used for point-defect calculations; relaxed unit cell used as the starting point, with a 15 Å vacuum layer and spin-polarized HSE06 DFT.
1 property
Simulated Supercell DfthBNStudied Material
Why these are connected
Related documents with shared materials, methods, properties, or citations.
Each sample groups how it was prepared, characterized, and measured. Click a card to expand.
7 × 7 × 1 hBN supercell used for point-defect calculations; relaxed unit cell used as the starting point, with a 15 Å vacuum layer and spin-polarized HSE06 DFT.
1 property
Simulated Supercell DfthBNStudied Material
Why these are connected
Related documents with shared materials, methods, properties, or citations.
Each sample groups how it was prepared, characterized, and measured. Click a card to expand.
7 × 7 × 1 hBN supercell used for point-defect calculations; relaxed unit cell used as the starting point, with a 15 Å vacuum layer and spin-polarized HSE06 DFT.
1 property
Simulated Supercell DfthBNStudied Material
Why these are connected
Related documents with shared materials, methods, properties, or citations.