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Table 1 Formation energy for the various doping configurations in the β-Si 3 N 4 nanowire

From: Ab initio design of nanostructures for solar energy conversion: a case study on silicon nitride nanowire

 

O-s-Si

O-s-N

C-s-Si

C-s-N

Cr-s-Si

Cr-s-N

Ef (eV)

10.25

0.75

5.11

3.62

3.81

8.50

  1. For example, O-s-Si means that O substitutes Si.

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