| A |
Absorbance at irradiation wavelength |
| Bipy |
2,2′-bipyridine |
| BODIPY |
4,4-Difluoro-4-bora-3a,4a-diaza-s-indacene |
| CT |
Charge transfer |
| CycHex |
Cyclohexane |
| DCM |
Dichloromethane |
| DFT |
Density functional theory |
| DIPY |
Heteroleptic p-block mono(dipyrrinato) complex |
| DPM |
Dipyrromethene |
| EnT |
Energy transfer |
| F |
Fraction of light absorbed |
|
HSO
|
Spin–orbital Hamiltonian |
| HAE |
Heavy atom effect |
| Hex |
Mixture of hexanes |
| MCH |
Methylcyclohexane |
| HOMO |
Highest occupied molecular orbital |
| HOMO-1 |
MO level one step lower in energy than the HOMO |
|
I
|
Integrated emission intensity |
|
I
0
|
Light intensity of the irradiation source |
| IC |
Internal Conversion |
|
1,3IL |
Singlet or triplet intraligand state |
|
1,3ILCT |
Singlet or triplet intraligand charge transfer state |
| ISC |
Intersystem crossing |
|
|
Fluorescence rate constant |
|
|
Intersystem crossing rate constant |
|
|
Nonradiative rate constant;
|
|
|
Phosphorescence rate constant |
|
|
Bimolecular quenching constant |
|
|
Radiative rate constant;
|
|
|
Stern-Volmer constant |
|
1,3LLCT |
Singlet or triplet ligand-to-ligand charge transfer, also called ICT state |
|
1,3LMCT |
Singlet or triplet ligand-to-metal charge transfer |
| LUMO |
Lowest unoccupied molecular orbital |
| LUMO + 1 |
MO level one step higher in energy than the LUMO |
|
1,3MC |
Singlet or triplet metal-centered |
| MeOH |
Methanol |
| Mes |
Mesityl |
|
1,3MLCT |
Singlet or triplet metal-to-ligand charge transfer state |
|
1,3MMCT |
Singlet or triplet metal-to-metal charge transfer state |
| MO |
Molecular orbital |
| MOF |
Metal-organic framework |
| n |
Refractive index |
| NIR |
Near-infrared region |
| PDT |
Photodynamic therapy |
| Ph |
Phenyl |
| PS |
Photosensitizer |
| Q |
Quencher (= 3O2 in PDT) |
| QY |
Quantum yield, see φ |
| r3
|
Mean cubic radial distribution of the electron |
| ROS |
Reactive oxygen species |
| SBCT |
Symmetry breaking charge transfer |
| SOC |
Spin–orbital coupling |
| S0
|
Singlet ground state |
| S1
|
First singlet excited state |
| TA |
Transient absorption |
| TDDFT |
Time dependent DFT |
| THF |
Tetrahydrofuran |
| TM |
Transition metal |
| Tol |
Toluene |
| TTA |
Triplet-triplet annihilation |
| T1
|
First triplet excited state |
| UV-Vis |
Ultra-violet – visible range |
| Z |
Atomic number |
| ∆λ |
Stokes shift in nm |
| ∆ES1−T1
|
Energy gap between the first triplet excited state and the first singlet excited state |
| ∆ET1−S0
|
Energy gap between the first triplet excited state and the ground state |
| ∆ṽ
|
Stokes shift in cm−1
|
| ∆ṽ0
|
Uncorrected Stokes shift in cm−1, obtained from eq. Equation (6) |
| ɛ |
Molar absorption coefficient |
| λ |
Wavelength (in cm−1) |
| λa
|
Wavelength at maximum absorption |
| λex
|
Excitation wavelength |
| λf
|
Wavelength at maximum emission |
| τ |
Lifetime of a state |
| τ0
|
Lifetime in the absence of Q |
| τr
|
Radiative lifetime |
| τS
|
Singlet state lifetime |
| τT
|
Triplet state lifetime |
|
|
Quantum yield (QY) |
|
|
Singlet oxygen quantum yield |
|
|
Fluorescence quantum yield |
|
|
Intersystem crossing quantum yield |
|
|
Quantum yield of triplet formation |