Table 1 The crystal structure of the co-doped MoS 2 monolayers
From: The electronic structure and optical properties of Mn and B, C, N co-doped MoS2 monolayers
h(S-S) | θ(S-Mo-S) | d(Mn-S) | d(Mn- X) | d(Mo- X) | |
|---|---|---|---|---|---|
Mn-B | 3.15 | 81.88 | 2.29 | 2.01 | 2.12 |
Mn-C | 3.14 | 81.44 | 2.32 | 1.93 | 2.05 |
Mn-N | 3.14 | 81.34 | 2.33 | 4.95 | 1.99 |