Host: Defect: ID: DOI:

WS2

Sc

qdg-1437

Defect Details

Defect Type: Substitution

Charge: -2

Point Group: D3h

Charge Stability Range: 0.008

Spin Multiplicity: 2

Optical Properties

Excitation energy ΔKS (eV): 0.6809

Transition Dipole Moment (D): 8.9557

Electronic Structure

Electronic Structure

Formation Energy

Formation Energy
Transition Charge Transition Level
-2/-1 2.275
-3/-2 3.2721