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Journal Abstract Search

284 related items for PubMed ID: 18307327

  • 41. Tuning electronic properties of functionalized polyhedral oligomeric silsesquioxanes: a DFT and TDDFT study.
    Zhen CG, Becker U, Kieffer J.
    J Phys Chem A; 2009 Sep 03; 113(35):9707-14. PubMed ID: 19670902
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  • 42. Substituent effects on twisted internal charge transfer excited states of N-borylated carbazoles and (diphenylamino)boranes.
    Wang J, Wang Y, Taniguchi T, Yamaguchi S, Irle S.
    J Phys Chem A; 2012 Feb 02; 116(4):1151-8. PubMed ID: 22208822
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  • 43. Geometric and excited-state properties of 1,4-bis(benzothiazolylvinyl)benzene interacting with 2,2',2' '-(1,3,5-phenylene)tris[1-phenyl-1H-benzimidazole] studied by a density-functional tight-binding method.
    Lin CS, Zhang RQ, Lee CS, Niehaus TA, Frauenheim T.
    J Phys Chem B; 2006 Oct 26; 110(42):20847-51. PubMed ID: 17048897
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  • 44. Theoretical study of absorption and emission properties of green and yellow emitting iridium(III) complexes.
    Kadari A, Moncomble A, Ciofini I, Brahimi M, Adamo C.
    J Phys Chem A; 2011 Oct 27; 115(42):11861-5. PubMed ID: 21888348
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  • 45. The influence of the relative position of the thiophene and pyrrole rings in donor-acceptor thienylpyrrolyl-benzothiazole derivatives. A photophysical and theoretical investigation.
    Pina J, Seixas de Melo JS, Batista RM, Costa SP, Raposo MM.
    Phys Chem Chem Phys; 2010 Sep 07; 12(33):9719-25. PubMed ID: 20544119
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  • 46. Photophysical, spectroscopic, and computational studies of a series of Re(I) tricarbonyl complexes containing 2,6-dimethylphenylisocyanide and 5- and 6-derivatized phenanthroline ligands.
    Villegas JM, Stoyanov SR, Huang W, Rillema DP.
    Inorg Chem; 2005 Apr 04; 44(7):2297-309. PubMed ID: 15792465
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  • 47. A large perturbation on geometry structures, excited state properties, charge-injection and -transporting abilities of Ir(III) complexes by different substituents on ligands: a DFT/TDDFT study.
    Liu SJ, Song NN, Wang JX, Huang YQ, Zhao Q, Liu XM, Sun S, Huang W.
    Phys Chem Chem Phys; 2011 Nov 07; 13(41):18497-506. PubMed ID: 21946861
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  • 48. Theoretical insight into the origin of large stokes shift and photophysical properties of anilido-pyridine boron difluoride dyes.
    Jin JL, Li HB, Geng Y, Wu Y, Duan YA, Su ZM.
    Chemphyschem; 2012 Nov 12; 13(16):3714-22. PubMed ID: 22899450
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  • 49. Experimental and theoretical study of two new pyrazoline derivatives based on dibenzofuran.
    Shi HP, Dai JX, Zhang XF, Xu L, Wang L, Shi LW, Fang L.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Dec 12; 83(1):242-9. PubMed ID: 21943713
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  • 50. Influence of geometry relaxation on the energies of the S1 and S2 states of violaxanthin, zeaxanthin, and lutein.
    Dreuw A.
    J Phys Chem A; 2006 Apr 06; 110(13):4592-9. PubMed ID: 16571067
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  • 51. Photoinduced intramolecular charge transfer and S2 fluorescence in thiophene-pi-conjugated donor-acceptor systems: experimental and TDDFT studies.
    Zhao GJ, Chen RK, Sun MT, Liu JY, Li GY, Gao YL, Han KL, Yang XC, Sun L.
    Chemistry; 2008 Apr 06; 14(23):6935-47. PubMed ID: 18576458
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  • 52. Synthesis, photophysical and electrochemical properties of a carbazole dimer-based derivative with benzothiazole units.
    Shi HP, Dai JX, Shi LW, Xu L, Zhou ZB, Zhang Y, Zhou W, Dong C.
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jul 06; 93():19-25. PubMed ID: 22459937
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  • 53. DFT/TDDFT exploration of the potential energy surfaces of the ground state and excited states of Fe2(S2C3H6)(CO)6: a simple functional model of the [FeFe] hydrogenase active site.
    Bertini L, Greco C, De Gioia L, Fantucci P.
    J Phys Chem A; 2009 May 14; 113(19):5657-70. PubMed ID: 19378958
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  • 54. Theoretical study on the correlation between band gap, bandwidth, and oscillator strength in fluorene-based donor-acceptor conjugated copolymers.
    Hung YC, Jiang JC, Chao CY, Su WF, Lin ST.
    J Phys Chem B; 2009 Jun 18; 113(24):8268-77. PubMed ID: 19473008
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  • 55. Localised to intraligand charge-transfer states in cyclometalated platinum complexes: an experimental and theoretical study into the influence of electron-rich pendants and modulation of excited states by ion binding.
    Rochester DL, Develay S, Zális S, Williams JA.
    Dalton Trans; 2009 Mar 14; (10):1728-41. PubMed ID: 19240906
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  • 56. Modeling of multifunctional donor-bridge-acceptor 4,6-di(thiophen-2-yl)pyrimidine derivatives: a first principles study.
    Irfan A, Al-Sehemi AG, Al-Assiri MS.
    J Mol Graph Model; 2013 Jul 14; 44():168-76. PubMed ID: 23835610
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  • 57. Chlorin-bacteriochlorin energy-transfer dyads as prototypes for near-infrared molecular imaging probes: controlling charge-transfer and fluorescence properties in polar media.
    Kee HL, Diers JR, Ptaszek M, Muthiah C, Fan D, Lindsey JS, Bocian DF, Holten D.
    Photochem Photobiol; 2009 Jul 14; 85(4):909-20. PubMed ID: 19222800
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  • 58. Theoretical study of the relations between structure and photophysical properties of model oligofluorenes with central keto defect.
    Lukes V, Solc R, Lischka H, Kauffmann HF.
    J Phys Chem A; 2009 Dec 24; 113(51):14141-9. PubMed ID: 19928889
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  • 59. Oligothiophene dendrimers as new building blocks for optical applications.
    Ramakrishna G, Bhaskar A, Bauerle P, Goodson T.
    J Phys Chem A; 2008 Mar 13; 112(10):2018-26. PubMed ID: 18044856
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  • 60. Photophysical and theoretical investigations of oligo(p-phenyleneethynylene)s: effect of alkoxy substitution and alkyne-aryl bond rotations.
    James PV, Sudeep PK, Suresh CH, Thomas KG.
    J Phys Chem A; 2006 Apr 06; 110(13):4329-37. PubMed ID: 16571035
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