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191 related items for PubMed ID: 16851609
1. Optical properties and delocalization of excess negative charges on oligo(phenylenevinylene)s: a quantum chemical study. Fratiloiu S, Grozema FC, Siebbeles LD. J Phys Chem B; 2005 Mar 31; 109(12):5644-52. PubMed ID: 16851609 [Abstract] [Full Text] [Related]
2. A density functional theory (DFT) and time-dependent density functional theory (TDDFT) study on optical transitions in oligo(p-phenylenevinylene)-fullerene dyads and the applicability to resonant energy transfer. Toivonen TL, Hukka TI. J Phys Chem A; 2007 Jun 07; 111(22):4821-8. PubMed ID: 17477511 [Abstract] [Full Text] [Related]
3. A theoretical, spectroscopic, and photophysical study of 2,7-carbazolenevinylene-based conjugated derivatives. Belletête M, Morin JF, Leclerc M, Durocher G. J Phys Chem A; 2005 Aug 11; 109(31):6953-9. PubMed ID: 16834054 [Abstract] [Full Text] [Related]
4. Impact of the computational method on the geometric and electronic properties of oligo(phenylene vinylene) radical cations. Geskin VM, Grozema FC, Siebbeles LD, Beljonne D, Brédas JL, Cornil J. J Phys Chem B; 2005 Nov 03; 109(43):20237-43. PubMed ID: 16853617 [Abstract] [Full Text] [Related]
5. Electronic structure and optical properties of charged oligofluorenes studied by VIS/NIR spectroscopy and time-dependent density functional theory. Fratiloiu S, Grozema FC, Koizumi Y, Seki S, Saeki A, Tagawa S, Dudek SP, Siebbeles LD. J Phys Chem B; 2006 Mar 30; 110(12):5984-93. PubMed ID: 16553407 [Abstract] [Full Text] [Related]
6. A first principles calculations and experimental study of the ground- and excited-state properties of ladder oligo(p-aniline)s. Belletête M, Durocher G, Hamel S, Côte M, Wakim S, Leclerc M. J Chem Phys; 2005 Mar 08; 122(10):104303. PubMed ID: 15839725 [Abstract] [Full Text] [Related]
7. A combined experimental and theoretical study on the effect of doping and interface formation on Ppv-ether copolymer. Mabrouk A, Alimi K, Molinié P, Nguyen TP. J Phys Chem B; 2006 Jan 26; 110(3):1141-50. PubMed ID: 16471656 [Abstract] [Full Text] [Related]
8. Study of electronic and spectroscopic properties on a newly synthesized red fluorescent material. Liu X, Ju H, Zhao X, Tao X, Bian W, Jiang M. J Chem Phys; 2006 May 07; 124(17):174711. PubMed ID: 16689594 [Abstract] [Full Text] [Related]
9. Tailoring transition metal complexes for nonlinear optics applications. 2. A theoretical investigation of the second-order nonlinear optical properties of M(CO)(5)L complexes (M = Cr, W; L = Py, PyCHO, Pyz, PyzBF(3), BPE, BPEBF(3)). Bruschi M, Fantucci P, Pizzotti M. J Phys Chem A; 2005 Oct 27; 109(42):9637-45. PubMed ID: 16866417 [Abstract] [Full Text] [Related]
12. Structural and spectral properties of 4-bromo-1-naphthyl chalcones: a quantum chemical study. Nithya R, Santhanamoorthi N, Kolandaivel P, Senthilkumar K. J Phys Chem A; 2011 Jun 23; 115(24):6594-602. PubMed ID: 21568269 [Abstract] [Full Text] [Related]
13. Effects of the 3- and 4-methoxy and acetamide substituents and solvent environment on the electronic properties of N-substituted 1,8-naphthalimide derivatives. Coronado JL, Martín E, Montero LA, Fierro JL, Vega JM. J Phys Chem A; 2007 Oct 04; 111(39):9724-32. PubMed ID: 17824598 [Abstract] [Full Text] [Related]