Electronic and Magnetic Structures of New Interstitial Boron Sub-Oxides B<sub>12</sub>O<sub>2</sub>:X (X = B, C, N, O)
The boron-rich boron sub-oxide rhombohedral B<sub>6</sub>O considered in B<sub>12</sub>O<sub>2</sub> full formulation has a large O-O spacing of ~3 Å and a central vacant position that can receive interstitial atoms X, forming a central O-X-O alignment in the dode...
Main Authors: | , |
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Format: | Article |
Language: | English |
Published: |
MDPI AG
2020-12-01
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Series: | Molecules |
Subjects: | |
Online Access: | https://www.mdpi.com/1420-3049/26/1/123 |