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14765 related items for PubMed ID: 19045282

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  • 5. Watching Na atoms solvate into (Na+,e-) contact pairs: untangling the ultrafast charge-transfer-to-solvent dynamics of Na- in tetrahydrofuran (THF).
    Cavanagh MC, Larsen RE, Schwartz BJ.
    J Phys Chem A; 2007 Jun 21; 111(24):5144-57. PubMed ID: 17523607
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  • 7. Importance of polarization in quantum mechanics/molecular mechanics descriptions of electronic excited states: NaI(H2O)n photodissociation dynamics as a case study.
    Koch DM, Peslherbe GH.
    J Phys Chem B; 2008 Jan 17; 112(2):636-49. PubMed ID: 18183959
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  • 9. Nonadiabatic molecular dynamics simulations of correlated electrons in solution. 1. Full configuration interaction (CI) excited-state relaxation dynamics of hydrated dielectrons.
    Larsen RE, Schwartz BJ.
    J Phys Chem B; 2006 May 18; 110(19):9681-91. PubMed ID: 16686519
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  • 13. The structure of the hydrated electron. Part 2. A mixed quantum/classical molecular dynamics embedded cluster density functional theory: single-excitation configuration interaction study.
    Shkrob IA, Glover WJ, Larsen RE, Schwartz BJ.
    J Phys Chem A; 2007 Jun 21; 111(24):5232-43. PubMed ID: 17530823
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  • 17. Dynamical calculations of charge-transfer-to-solvent excited states of small I- (CH3CN)n clusters.
    Takayanagi T.
    J Phys Chem A; 2006 Jun 08; 110(22):7011-8. PubMed ID: 16737248
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  • 18. CHARMM fluctuating charge force field for proteins: II protein/solvent properties from molecular dynamics simulations using a nonadditive electrostatic model.
    Patel S, Mackerell AD, Brooks CL.
    J Comput Chem; 2004 Sep 08; 25(12):1504-14. PubMed ID: 15224394
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  • 19. Nonadiabatic trajectory studies of NaI(H2O)n photodissociation dynamics.
    Koch DM, Timerghazin QK, Peslherbe GH, Ladanyi BM, Hynes JT.
    J Phys Chem A; 2006 Feb 02; 110(4):1438-54. PubMed ID: 16435804
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