Host: Defect: ID: DOI:

WS2

Fe

qdg-1006

Defect Details

Defect Type: Substitution

Charge: 1

Point Group: C3v

Charge Stability Range: 0.339

Spin Multiplicity: 4

Optical Properties

Excitation energy ΔKS (eV): 1.1236

Transition Dipole Moment (D): 3.8917

Electronic Structure

Electronic Structure

Formation Energy

Formation Energy
Transition Charge Transition Level
2/1 -0.8803
0/1 0.778