Host: Defect: ID: DOI:

WS2

Sc

qdg-1088

Defect Details

Defect Type: Substitution

Charge: 1

Point Group: C3v

Charge Stability Range: 0.234

Spin Multiplicity: 3

Optical Properties

Excitation energy ΔKS (eV): 0.9745

Transition Dipole Moment (D): 2.5008

Electronic Structure

Electronic Structure

Formation Energy

Formation Energy
Transition Charge Transition Level
1/2 -0.1475
1/0 0.5375