560 related articles for article (PubMed ID: 17078617)
41. Time-dependent density functional theory study on intramolecular charge transfer and solvent effect of dimethylaminobenzophenone.
Duan XH; Li XY; He RX; Cheng XM
J Chem Phys; 2005 Feb; 122(8):84314. PubMed ID: 15836046
[TBL] [Abstract][Full Text] [Related]
42. Photoinduced intramolecular electron-transfer processes in [60]fullerene-(Spacer)-N,N-bis(biphenylyl)aniline dyad in solutions.
Rajkumar GA; Sandanayaka AS; Ikeshita K; Itou M; Araki Y; Furusho Y; Kihara N; Ito O; Takata T
J Phys Chem A; 2005 Mar; 109(11):2428-35. PubMed ID: 16833542
[TBL] [Abstract][Full Text] [Related]
43. Selective triplet-state formation during charge recombination in a fullerene/Bodipy molecular dyad (Bodipy=borondipyrromethene).
Ziessel R; Allen BD; Rewinska DB; Harriman A
Chemistry; 2009 Jul; 15(30):7382-93. PubMed ID: 19551782
[TBL] [Abstract][Full Text] [Related]
44. Preparation, characterization, molecular and electronic structures, TDDFT, and TDDFT/PCM study of the solvatochromism in cyanovinylferrocenes.
Nemykin VN; Makarova EA; Grosland JO; Hadt RG; Koposov AY
Inorg Chem; 2007 Nov; 46(23):9591-601. PubMed ID: 17918928
[TBL] [Abstract][Full Text] [Related]
45. Modulating charge separation and charge recombination dynamics in porphyrin-fullerene linked dyads and triads: Marcus-normal versus inverted region.
Imahori H; Tamaki K; Guldi DM; Luo C; Fujitsuka M; Ito O; Sakata Y; Fukuzumi S
J Am Chem Soc; 2001 Mar; 123(11):2607-17. PubMed ID: 11456930
[TBL] [Abstract][Full Text] [Related]
46. A computational study of the ground and excited state structure and absorption spectra of free-base N-confused porphine and free-base N-confused tetraphenylporphyrin.
Vyas S; Hadad CM; Modarelli DA
J Phys Chem A; 2008 Jul; 112(29):6533-49. PubMed ID: 18593108
[TBL] [Abstract][Full Text] [Related]
47. Computational approaches to charge transfer excitations in a zinc tetraphenylporphyrin and C70 complex.
Ghosh P; Gebauer R
J Chem Phys; 2010 Mar; 132(10):104102. PubMed ID: 20232942
[TBL] [Abstract][Full Text] [Related]
48. Comparative theoretical investigation of the vertical excitation energies and the electronic structure of [MoVOCl4]-: influence of basis set and geometry.
Nemykin VN; Basu P
Inorg Chem; 2003 Jun; 42(13):4046-56. PubMed ID: 12817960
[TBL] [Abstract][Full Text] [Related]
49. Equilibrium, photophysical, photochemical, and quantum chemical examination of anionic mercury(II) mono- and bisporphyrins.
Valicsek Z; Lendvay G; Horváth O
J Phys Chem B; 2008 Nov; 112(46):14509-24. PubMed ID: 18954102
[TBL] [Abstract][Full Text] [Related]
50. Study of photoinduced electron transfer between [60]fullerene and proton-sponge by laser flash photolysis: addition effects of organic acid.
Horie R; Araki Y; Ito O; Lee Y; Kitagawa T; Komatsu K
J Phys Chem A; 2005 Jul; 109(28):6140-6. PubMed ID: 16833953
[TBL] [Abstract][Full Text] [Related]
51. Prolongation of the lifetime of the charge-separated state at low temperatures in a photoinduced electron-transfer system of [60]fullerene and ferrocene moieties tethered by rotaxane structures.
Rajkumar GA; Sandanayaka AS; Ikeshita K; Araki Y; Furusho Y; Takata T; Ito O
J Phys Chem B; 2006 Apr; 110(13):6516-25. PubMed ID: 16570949
[TBL] [Abstract][Full Text] [Related]
52. Electronically excited states of vitamin B12: benchmark calculations including time-dependent density functional theory and correlated ab initio methods.
Kornobis K; Kumar N; Wong BM; Lodowski P; Jaworska M; Andruniów T; Ruud K; Kozlowski PM
J Phys Chem A; 2011 Feb; 115(7):1280-92. PubMed ID: 21280654
[TBL] [Abstract][Full Text] [Related]
53. DFT Calculations on Charge-Transfer States of a Carotenoid-Porphyrin-C60 Molecular Triad.
Baruah T; Pederson MR
J Chem Theory Comput; 2009 Apr; 5(4):834-43. PubMed ID: 26609590
[TBL] [Abstract][Full Text] [Related]
54. Supramolecular carbon nanotube-fullerene donor-acceptor hybrids for photoinduced electron transfer.
D'Souza F; Chitta R; Sandanayaka AS; Subbaiyan NK; D'Souza L; Araki Y; Ito O
J Am Chem Soc; 2007 Dec; 129(51):15865-71. PubMed ID: 18052162
[TBL] [Abstract][Full Text] [Related]
55. Calculation of excitation energies of open-shell molecules with spatially degenerate ground states. II. Transformed reference via intermediate configuration Kohn-Sham time dependent density functional theory oscillator strengths and magnetic circular dichroism C terms.
Seth M; Ziegler T
J Chem Phys; 2006 Apr; 124(14):144105. PubMed ID: 16626178
[TBL] [Abstract][Full Text] [Related]
56. Metal quinolinolate-fullerene(s) donor-acceptor complexes: evidence for organic LED molecules acting as electron donors in photoinduced electron-transfer reactions.
D'Souza F; Maligaspe E; Zandler ME; Subbaiyan NK; Ohkubo K; Fukuzumi S
J Am Chem Soc; 2008 Dec; 130(50):16959-67. PubMed ID: 19053486
[TBL] [Abstract][Full Text] [Related]
57. Mechanism of ligand photodissociation in photoactivable [Ru(bpy)2L2]2+ complexes: a density functional theory study.
Salassa L; Garino C; Salassa G; Gobetto R; Nervi C
J Am Chem Soc; 2008 Jul; 130(29):9590-7. PubMed ID: 18588292
[TBL] [Abstract][Full Text] [Related]
58. Vibronic effects in the 1(1)B(u)(1(1)B(2)) excited singlet states of oligothiophenes. fluorescence study of the 1(1)A(g)(1(1)A(1)) <-- 1(1)B(u)(1(1)B(2)) transition in terms of DFT, TDDFT, and CASSCF methods.
Andrzejak M; Pawlikowski MT
J Phys Chem A; 2008 Dec; 112(51):13737-44. PubMed ID: 19053502
[TBL] [Abstract][Full Text] [Related]
59. Electronic transitions involved in the absorption spectrum and dual luminescence of tetranuclear cubane [Cu4I4(pyridine)4] cluster: a density functional theory/time-dependent density functional theory investigation.
De Angelis F; Fantacci S; Sgamellotti A; Cariati E; Ugo R; Ford PC
Inorg Chem; 2006 Dec; 45(26):10576-84. PubMed ID: 17173412
[TBL] [Abstract][Full Text] [Related]
60. Photoinduced energy and electron-transfer processes in porphyrin-perylene bisimide symmetric triads.
Ghirotti M; Chiorboli C; You CC; Würthner F; Scandola F
J Phys Chem A; 2008 Apr; 112(15):3376-85. PubMed ID: 18335911
[TBL] [Abstract][Full Text] [Related]
[Previous] [Next] [New Search]
