Host: Defect: ID: DOI:

WS2

Tl

qdg-1274

Defect Details

Defect Type: Substitution

Charge: -1

Point Group: D3h

Charge Stability Range: 0.368

Spin Multiplicity: 1

Optical Properties

Excitation energy ΔKS (eV): 0.4665

Transition Dipole Moment (D): 11.5838

Electronic Structure

Electronic Structure

Formation Energy

Formation Energy
Transition Charge Transition Level
-1/0 1.4481
-1/-2 2.4732