Host: Defect: ID: DOI:

WS2

Hf

qdg-1425

Defect Details

Defect Type: Substitution

Charge: -2

Point Group: D3h

Charge Stability Range: 0.11

Spin Multiplicity: 1

Optical Properties

Excitation energy ΔKS (eV): 1.5744

Transition Dipole Moment (D): 0.0946

Electronic Structure

Electronic Structure

Formation Energy

Formation Energy
Transition Charge Transition Level
-2/-1 2.0415