249 related articles for article (PubMed ID: 15267712)
1. Theoretical prediction of electronic structures of fully pi-conjugated zinc oligoporphyrins with curved surface structures.
Yamaguchi Y
J Chem Phys; 2004 May; 120(17):7963-70. PubMed ID: 15267712
[TBL] [Abstract][Full Text] [Related]
2. Effects of fluorination on electronic and excited states of fused zinc oligoporphyrins.
Yamaguchi Y
J Chem Phys; 2005 May; 122(18):184702. PubMed ID: 15918742
[TBL] [Abstract][Full Text] [Related]
3. Fully conjugated porphyrin tapes with electronic absorption bands that reach into infrared.
Tsuda A; Osuka A
Science; 2001 Jul; 293(5527):79-82. PubMed ID: 11441176
[TBL] [Abstract][Full Text] [Related]
4. Influence of molecular geometry, exchange-correlation functional, and solvent effects in the modeling of vertical excitation energies in phthalocyanines using time-dependent density functional theory (TDDFT) and polarized continuum model TDDFT methods: can modern computational chemistry methods explain experimental controversies?
Nemykin VN; Hadt RG; Belosludov RV; Mizuseki H; Kawazoe Y
J Phys Chem A; 2007 Dec; 111(50):12901-13. PubMed ID: 18004829
[TBL] [Abstract][Full Text] [Related]
5. Directly linked porphyrin arrays.
Aratani N; Osuka A
Chem Rec; 2003; 3(4):225-34. PubMed ID: 14595831
[TBL] [Abstract][Full Text] [Related]
6. Electronic structures of azulene-fused porphyrins as seen by magnetic circular dichroism and TD-DFT calculations.
Nakai K; Kurotobi K; Osuka A; Uchiyama M; Kobayashi N
J Inorg Biochem; 2008 Mar; 102(3):466-71. PubMed ID: 18180040
[TBL] [Abstract][Full Text] [Related]
7. A systematic theoretical study of the electronic structures of porphyrin dimers: DFT and TD-DFT calculations on diporphyrins linked by ethane, ethene, ethyne, imine, and azo bridges.
Rintoul L; Harper SR; Arnold DP
Phys Chem Chem Phys; 2013 Nov; 15(43):18951-64. PubMed ID: 24097279
[TBL] [Abstract][Full Text] [Related]
8. Effects of substituents on synthetic analogs of chlorophylls. Part 2: Redox properties, optical spectra and electronic structure.
Kee HL; Kirmaier C; Tang Q; Diers JR; Muthiah C; Taniguchi M; Laha JK; Ptaszek M; Lindsey JS; Bocian DF; Holten D
Photochem Photobiol; 2007; 83(5):1125-43. PubMed ID: 17880507
[TBL] [Abstract][Full Text] [Related]
9. Comparison of DFT methods for molecular orbital eigenvalue calculations.
Zhang G; Musgrave CB
J Phys Chem A; 2007 Mar; 111(8):1554-61. PubMed ID: 17279730
[TBL] [Abstract][Full Text] [Related]
10. Synthesis, spectroscopic and electrochemical properties, and electronic structures of octahedral hexatechnetium(III) clusters [Tc6Q8(CN)6]4- (Q = S, Se).
Yoshimura T; Ikai T; Takayama T; Sekine T; Kino Y; Shinohara A
Inorg Chem; 2010 Jul; 49(13):5876-82. PubMed ID: 20518481
[TBL] [Abstract][Full Text] [Related]
11. Highly pure synthesis, spectral assignments, and two-photon properties of cruciform porphyrin pentamers fused with benzene units.
Uoyama H; Kim KS; Kuroki K; Shin JY; Nagata T; Okujima T; Yamada H; Ono N; Kim D; Uno H
Chemistry; 2010 Apr; 16(13):4063-74. PubMed ID: 20175163
[TBL] [Abstract][Full Text] [Related]
12. A theoretical study on the third-order nonlinear optical properties of pi-conjugated linear porphyrin arrays.
Matsuzaki Y; Nogami A; Tsuda A; Osuka A; Tanaka K
J Phys Chem A; 2006 Apr; 110(14):4888-99. PubMed ID: 16599459
[TBL] [Abstract][Full Text] [Related]
13. Modulation of the electronic structure of semiconducting nanotubes resulting from different metal contacts.
Tarakeshwar P; Kim DM
J Phys Chem B; 2005 Apr; 109(16):7601-4. PubMed ID: 16851878
[TBL] [Abstract][Full Text] [Related]
14. Electronic structure of tubular aromatic molecules derived from the metallic (5,5) armchair single wall carbon nanotube.
Zhou Z; Steigerwald M; Hybertsen M; Brus L; Friesner RA
J Am Chem Soc; 2004 Mar; 126(11):3597-607. PubMed ID: 15025489
[TBL] [Abstract][Full Text] [Related]
15. Nature of the intense near-IR absorption and unusual broad UV-visible-NIR spectra of azulenocyanines: density functional theory studies.
Qi D; Zhang L; Zhang Y; Bian Y; Jiang J
J Phys Chem A; 2010 Dec; 114(51):13411-7. PubMed ID: 21141865
[TBL] [Abstract][Full Text] [Related]
16. Electron-phonon interactions and Jahn-Teller effects in the monocation of corannulene.
Kato T; Yamabe T
J Phys Chem A; 2006 Mar; 110(8):2785-95. PubMed ID: 16494390
[TBL] [Abstract][Full Text] [Related]
17. Boron fullerenes B(32+8k) with four-membered rings and B32 solid phases: geometrical structures and electronic properties.
Sheng XL; Yan QB; Zheng QR; Su G
Phys Chem Chem Phys; 2009 Nov; 11(42):9696-702. PubMed ID: 19851546
[TBL] [Abstract][Full Text] [Related]
18. Excited state properties, fluorescence energies, and lifetime of a poly(fluorene-pyridine) copolymer, based on TD-DFT investigation.
Chidthong R; Hannongbua S; Aquino AJ; Wolschann P; Lischka H
J Comput Chem; 2007 Jul; 28(10):1735-42. PubMed ID: 17340608
[TBL] [Abstract][Full Text] [Related]
19. Theoretical and experimental investigation on the electronic properties of the shuttlecock shaped and the double-decker structured metal phthalocyanines, MPc and M(Pc)2 (M = Sn and Pb).
Sumimoto M; Honda T; Kawashima Y; Hori K; Fujimoto H
Dalton Trans; 2012 Jun; 41(23):7141-50. PubMed ID: 22569961
[TBL] [Abstract][Full Text] [Related]
20. The effect of conjugated spacer on novel carbazole derivatives for dye-sensitized solar cells: density functional theory/time-dependent density functional theory study.
Jungsuttiwong S; Yakhanthip T; Surakhot Y; Khunchalee J; Sudyoadsuk T; Promarak V; Kungwan N; Namuangruk S
J Comput Chem; 2012 Jun; 33(17):1517-23. PubMed ID: 22505327
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
