Resonance Raman excitation profiles for the permanganate ion: calculation of Franck-Condon scattering contributions for the totally symmetric fundamental and its overtones and of the equilibrium manganese oxide (MnO) bond length in the first 1T2 excited state

1981 ◽  
Vol 103 (22) ◽  
pp. 6593-6599 ◽  
Author(s):  
Robin J. H. Clark ◽  
Brian Stewart

1980 ◽  
Vol 69 (3) ◽  
pp. 488-490 ◽  
Author(s):  
Robin J.H. Clark ◽  
David G. Cobbold ◽  
Brian Stewart


1999 ◽  
Vol 19 (1-4) ◽  
pp. 51-56
Author(s):  
Gregory D. Scholes ◽  
Thierry Fournier ◽  
David Phillips ◽  
Anthony W. Parker

Dynamics subsequent to the electronic excitation of 9,9′-bianthryl produce a polar emissive excited state for which the symmetry of the bichromophore is broken by a dynamic solvent stabilisation of one of the two, otherwise degenerate, charge transfer configurations which contribute to the excited electronic state. The initial state created upon excitation is examined here by analysis of ground state resonance Raman excitation profiles (REPs) and electronic absorption spectra in solvents of various polarities. The results suggest that the REPs are signalling electronic differences between the initially excited state in the various solvents. We suggest that this is related to the bianthryl excited state being responsive to the disordered solvent environment.



1999 ◽  
Vol 299 (2) ◽  
pp. 187-194 ◽  
Author(s):  
Tokutake Sashima ◽  
Hiroyoshi Nagae ◽  
Michitaka Kuki ◽  
Yasushi Koyama


2021 ◽  
Author(s):  
Federico Coppola ◽  
Paola Cimino ◽  
Umberto Raucci ◽  
Maria Gabriella Chiariello ◽  
Alessio Petrone ◽  
...  

We present electronic structure methods to unveil non-radiative pathways of photoinduced charge transfer (CT) reactions that play a main role in photophysics and light harvesting technologies. A prototypical π-stacked molecular...



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