Host: Defect: ID: DOI:

WS2

Zr

qdg-1080

Defect Details

Defect Type: Substitution

Charge: 2

Point Group: Cs

Charge Stability Range: 0

Spin Multiplicity: 1

Optical Properties

Excitation energy ΔKS (eV): 0.4718

Transition Dipole Moment (D): 6.1921

Electronic Structure

Electronic Structure

Formation Energy

Formation Energy
Transition Charge Transition Level
1/2 -0.4155