Host: Defect: ID: DOI:

WS2

Ba

qdg-1463

Defect Details

Defect Type: Substitution

Charge: -1

Point Group: C2v

Charge Stability Range: 0.44

Spin Multiplicity: 2

Optical Properties

Excitation energy ΔKS (eV): 0.48

Transition Dipole Moment (D): 8.1929

Electronic Structure

Electronic Structure

Formation Energy

Formation Energy
Transition Charge Transition Level
-1/0 1.2835
-1/-2 2.3814