Theoretical study of the electronic structure and luminescence of trinuclear gold complex.
Sansores, L.E. Salcedo, R. Flores, H. Martinez, A.
Theoretical study of the electronic structure and luminescence of trinuclear gold complex. - 2000. - Vol. 530, no. 1-2, 18 Sept., pp. 125-129. = Journal of Molecular Structure: Theochem
Excited states
Gold compounds
Luminescence
Molecular electronic states
Organometallic compounds
Photoluminescence
Triplet state
Electronic structure
Luminescence
Trinuclear gold complex
Trimeric organometallic complex
Gas phase
Chloroform solution
B3LYP/6-31++G level
Vibrational frequencies
Molecular structure
Triplet state
Excited state
Emission transition
Alpha -HOMO
Beta -LUMO
Solvoluminescence
LANL2DZ basis
Molecular orbitals
Electronic parameters
Two-step transition
Theoretical study of the electronic structure and luminescence of trinuclear gold complex. - 2000. - Vol. 530, no. 1-2, 18 Sept., pp. 125-129. = Journal of Molecular Structure: Theochem
Excited states
Gold compounds
Luminescence
Molecular electronic states
Organometallic compounds
Photoluminescence
Triplet state
Electronic structure
Luminescence
Trinuclear gold complex
Trimeric organometallic complex
Gas phase
Chloroform solution
B3LYP/6-31++G level
Vibrational frequencies
Molecular structure
Triplet state
Excited state
Emission transition
Alpha -HOMO
Beta -LUMO
Solvoluminescence
LANL2DZ basis
Molecular orbitals
Electronic parameters
Two-step transition