Photodeactivation Channels of Transition Metal Complexes …
283
10. Baryshnikov G, Minaev B, Ågren H (2017) Theory and calculation of the phosphorescence
phenomenon. Chem Rev 117:6500–6537
11. Uoyama H, Goushi K, Shizu K, Nomura H, Adachi C (2012) Highly efficient organic lightemitting diodes from delayed fluorescence. Nature 492:234–238
12. Sousa C, Alías M, Domingo A, de Graaf C (2018) Deactivation of excited states in transition
metal complexes: insight from computational chemistry. Chem Eur J. https://doi.org/10.1002/
chem.201801990
13. Chergui M (2015) Ultrafast photophysics of transition metal complexes. Acc Chem Res
48:801–808
14. Chergui M (2012) On the interplay between charge, spin and structural dynamics in transition
metal complexes. Dalton Trans 41:13022–13029
15. Tang KC, Liu KL, Chen IC (2004) Rapid intersystem crossin in highly phosphorescent iridium
complexes. Chem Phys Lett 386:437–441
16. Cannizzo A, Blanco-Rodríguez AM, El Nahhas A, Szebera J, Zalis S, Vlˇ cek A, Chergui M (2008) Femtosecond fluorescence and intersystem crossing in Rhenium(I) carbonylbipyridine complexes. J Am Chem Soc 130:8967–8974
17. Cannizzo A, van Mourik F, Gawelda W, Zgrablic G, Bressler C, Chergui M (2006) Broadband
femtosecond fluorescence spectroscopy of [Ru(bpy) 3 ] 2+ . Angew Chem Int Ed 45:3174–3176
18. Damrauer NH, Cerullo G, Yeh A, Boussie TR, Shank CV, McCusker JK (1997) Femtosecond
dynamics of excited-state evolution in [Ru(bpy) 3 ] 2+ . Science 275:54–57
19. van der Veen RM, Cannizzo A, van Mourik F, Vlˇ cek A, Chergui M (2011) Vibrational relaxation and intersystem crossing of binuclear metal complexes in solution. J Am Chem Soc
133:305–315
20. Kukura P, McCamant DW, Mathies RA (2007) Femtosecond stimulated raman spectroscopy.
Annu Rev Phys Chem 58:461–488
21. Yoon S, Kukura P, Stuart CM, Mathies RA (2006) Direct observation of the ultrafast intersystem crossing in tris (2, 2-bipyridine) Ruthenium(II) using femtosecond stimulated raman
spectroscopy. Mol Phys 104:1275–1282
22. Smeigh AL, Creelman M, Mathies RA, McCusker JK (2008) Femtosecond time-resolved
optical and raman spectroscopy of photoinduced spin crossover: temporal resolution of lowto-high spin optical switching. J Am Chem Soc 130:14105–14107
23. Chergui M, Zewail AH (2009) Electron and X-ray methods of ultrafast structural dynamics:
advances and applications. Chem Phys Chem 10:28–43
24. Zhang W, Alonso-Mori R, Bergmann U, Bressler C, Chollet M, Galler A, Gawelda W, Hadt
RG, Hartsock RW, Kroll T, Kjaer KS, Kubicek K, Lemke HT, Liang HW, Meyer DA, Nielsen
MM, Purser C, Robinson JS, Solomon EI, Sun Z, Sokaras D, van Driel TB, Vanko G, Weng
TC, Zhu D, Gaffney KJ (2014) Tracking excited-state charge and spin dynamics in iron
coordination complexes. Nature 509:345–348
25. Jonas DM (2003) Two-dimensional femtosecond spectroscopy. Annu Rev Phys Chem
54:425–463
26. Carbery WP, Verma A, Turner DB (2017) Spin-orbit coupling drives femtosecond nonadiabatic dynamics in a transition metal compound. J Phys Chem Lett 8:1315–1322
27. Heitz MC, Finger K, Daniel C (1997) Photochemistry of organometallics: quantum chemistry
and photodissociation dynamics. Coord Chem Rev 159:171–193
28. Ribbing C, Daniel C (1994) Spin-orbit coupled excited states in transition metal complexes:
a configuration interaction treatment of HCo(CO) 4 . J Chem Phys 100:6591
29. Casida ME, Huix-Rotllant M (2012) Progress in time-dependent density-functional theory.
Annu Rev Phys Chem 63:287–323
30. Escudero D, Laurent A, Jacquemin D (2017) Time-dependent density functional theory: a tool
to explore excited states. In: Leszczynski J, Kaczmarek-Kedziera A, Puzyn T, Papadopoulos
M, Reis HK, Shukla M (eds) Handbook of computational chemistry. Springer, Cham, pp 1–43
31. Englman R, Jortner J (1970) The energy gap law for radiationless transitions in large
molecules. Mol Phys 18:145–164
283
10. Baryshnikov G, Minaev B, Ågren H (2017) Theory and calculation of the phosphorescence
phenomenon. Chem Rev 117:6500–6537
11. Uoyama H, Goushi K, Shizu K, Nomura H, Adachi C (2012) Highly efficient organic lightemitting diodes from delayed fluorescence. Nature 492:234–238
12. Sousa C, Alías M, Domingo A, de Graaf C (2018) Deactivation of excited states in transition
metal complexes: insight from computational chemistry. Chem Eur J. https://doi.org/10.1002/
chem.201801990
13. Chergui M (2015) Ultrafast photophysics of transition metal complexes. Acc Chem Res
48:801–808
14. Chergui M (2012) On the interplay between charge, spin and structural dynamics in transition
metal complexes. Dalton Trans 41:13022–13029
15. Tang KC, Liu KL, Chen IC (2004) Rapid intersystem crossin in highly phosphorescent iridium
complexes. Chem Phys Lett 386:437–441
16. Cannizzo A, Blanco-Rodríguez AM, El Nahhas A, Szebera J, Zalis S, Vlˇ cek A, Chergui M (2008) Femtosecond fluorescence and intersystem crossing in Rhenium(I) carbonylbipyridine complexes. J Am Chem Soc 130:8967–8974
17. Cannizzo A, van Mourik F, Gawelda W, Zgrablic G, Bressler C, Chergui M (2006) Broadband
femtosecond fluorescence spectroscopy of [Ru(bpy) 3 ] 2+ . Angew Chem Int Ed 45:3174–3176
18. Damrauer NH, Cerullo G, Yeh A, Boussie TR, Shank CV, McCusker JK (1997) Femtosecond
dynamics of excited-state evolution in [Ru(bpy) 3 ] 2+ . Science 275:54–57
19. van der Veen RM, Cannizzo A, van Mourik F, Vlˇ cek A, Chergui M (2011) Vibrational relaxation and intersystem crossing of binuclear metal complexes in solution. J Am Chem Soc
133:305–315
20. Kukura P, McCamant DW, Mathies RA (2007) Femtosecond stimulated raman spectroscopy.
Annu Rev Phys Chem 58:461–488
21. Yoon S, Kukura P, Stuart CM, Mathies RA (2006) Direct observation of the ultrafast intersystem crossing in tris (2, 2-bipyridine) Ruthenium(II) using femtosecond stimulated raman
spectroscopy. Mol Phys 104:1275–1282
22. Smeigh AL, Creelman M, Mathies RA, McCusker JK (2008) Femtosecond time-resolved
optical and raman spectroscopy of photoinduced spin crossover: temporal resolution of lowto-high spin optical switching. J Am Chem Soc 130:14105–14107
23. Chergui M, Zewail AH (2009) Electron and X-ray methods of ultrafast structural dynamics:
advances and applications. Chem Phys Chem 10:28–43
24. Zhang W, Alonso-Mori R, Bergmann U, Bressler C, Chollet M, Galler A, Gawelda W, Hadt
RG, Hartsock RW, Kroll T, Kjaer KS, Kubicek K, Lemke HT, Liang HW, Meyer DA, Nielsen
MM, Purser C, Robinson JS, Solomon EI, Sun Z, Sokaras D, van Driel TB, Vanko G, Weng
TC, Zhu D, Gaffney KJ (2014) Tracking excited-state charge and spin dynamics in iron
coordination complexes. Nature 509:345–348
25. Jonas DM (2003) Two-dimensional femtosecond spectroscopy. Annu Rev Phys Chem
54:425–463
26. Carbery WP, Verma A, Turner DB (2017) Spin-orbit coupling drives femtosecond nonadiabatic dynamics in a transition metal compound. J Phys Chem Lett 8:1315–1322
27. Heitz MC, Finger K, Daniel C (1997) Photochemistry of organometallics: quantum chemistry
and photodissociation dynamics. Coord Chem Rev 159:171–193
28. Ribbing C, Daniel C (1994) Spin-orbit coupled excited states in transition metal complexes:
a configuration interaction treatment of HCo(CO) 4 . J Chem Phys 100:6591
29. Casida ME, Huix-Rotllant M (2012) Progress in time-dependent density-functional theory.
Annu Rev Phys Chem 63:287–323
30. Escudero D, Laurent A, Jacquemin D (2017) Time-dependent density functional theory: a tool
to explore excited states. In: Leszczynski J, Kaczmarek-Kedziera A, Puzyn T, Papadopoulos
M, Reis HK, Shukla M (eds) Handbook of computational chemistry. Springer, Cham, pp 1–43
31. Englman R, Jortner J (1970) The energy gap law for radiationless transitions in large
molecules. Mol Phys 18:145–164