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Journal Abstract Search

1306 related items for PubMed ID: 20590193

  • 1. Insights into the ultraviolet spectrum of liquid water from model calculations.
    Cabral do Couto P, Chipman DM.
    J Chem Phys; 2010 Jun 28; 132(24):244307. PubMed ID: 20590193
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  • 3. Charge-transfer excited states in a pi-stacked adenine dimer, as predicted using long-range-corrected time-dependent density functional theory.
    Lange AW, Rohrdanz MA, Herbert JM.
    J Phys Chem B; 2008 May 22; 112(20):6304-8. PubMed ID: 18438995
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  • 5. Spectroscopically determined force field for water dimer: physically enhanced treatment of hydrogen bonding in molecular mechanics energy functions.
    Mannfors B, Palmo K, Krimm S.
    J Phys Chem A; 2008 Dec 11; 112(49):12667-78. PubMed ID: 19012387
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  • 8. Absorption spectrum of OH radical in water.
    Chipman DM.
    J Phys Chem A; 2008 Dec 25; 112(51):13372-81. PubMed ID: 19053573
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  • 11. Spectroscopic consequences of a mixed valence excited state: quantitative treatment of a dihydrazine diradical dication.
    Lockard JV, Zink JI, Konradsson AE, Weaver MN, Nelsen SF.
    J Am Chem Soc; 2003 Nov 05; 125(44):13471-80. PubMed ID: 14583043
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  • 12. The roles of electronic exchange and correlation in charge-transfer- to-solvent dynamics: Many-electron nonadiabatic mixed quantum/classical simulations of photoexcited sodium anions in the condensed phase.
    Glover WJ, Larsen RE, Schwartz BJ.
    J Chem Phys; 2008 Oct 28; 129(16):164505. PubMed ID: 19045282
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  • 13. Absorption and fluorescence properties of oligothiophene biomarkers from long-range-corrected time-dependent density functional theory.
    Wong BM, Piacenza M, Della Sala F.
    Phys Chem Chem Phys; 2009 Jun 14; 11(22):4498-508. PubMed ID: 19475168
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  • 15. Full dimensional (15-dimensional) quantum-dynamical simulation of the protonated water-dimer III: Mixed Jacobi-valence parametrization and benchmark results for the zero point energy, vibrationally excited states, and infrared spectrum.
    Vendrell O, Brill M, Gatti F, Lauvergnat D, Meyer HD.
    J Chem Phys; 2009 Jun 21; 130(23):234305. PubMed ID: 19548725
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  • 18. First singlet (n,pi*) excited state of hydrogen-bonded complexes between water and pyrimidine.
    Cai ZL, Reimers JR.
    J Phys Chem A; 2005 Mar 03; 109(8):1576-86. PubMed ID: 16833480
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  • 19. Photochemistry of the water dimer: time-dependent quantum wave-packet description of the dynamics at the S1-S0 conical intersection.
    Chmura B, Lan Z, Rode MF, Sobolewski AL.
    J Chem Phys; 2009 Oct 07; 131(13):134307. PubMed ID: 19814553
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