664 related articles for article (PubMed ID: 18069831)
1. Charge-transfer-to-solvent-driven dissolution dynamics of I- (H2O)2-5 upon excitation: excited-state ab initio molecular dynamics simulations.
Kołaski M; Lee HM; Pak C; Kim KS
J Am Chem Soc; 2008 Jan; 130(1):103-12. PubMed ID: 18069831
[TBL] [Abstract][Full Text] [Related]
2. Dynamics of electron solvation in molecular clusters.
Ehrler OT; Neumark DM
Acc Chem Res; 2009 Jun; 42(6):769-77. PubMed ID: 19361211
[TBL] [Abstract][Full Text] [Related]
3. 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; 112(2):636-49. PubMed ID: 18183959
[TBL] [Abstract][Full Text] [Related]
4. Ground state structures and excited state dynamics of pyrrole-water complexes: ab initio excited state molecular dynamics simulations.
Kumar A; Kołaski M; Kim KS
J Chem Phys; 2008 Jan; 128(3):034304. PubMed ID: 18205495
[TBL] [Abstract][Full Text] [Related]
5. The ultrafast charge-transfer-to-solvent dynamics of iodide in tetrahydrofuran. 1. Exploring the roles of solvent and solute electronic structure in condensed-phase charge-transfer reactions.
Bragg AE; Schwartz BJ
J Phys Chem B; 2008 Jan; 112(2):483-94. PubMed ID: 18085770
[TBL] [Abstract][Full Text] [Related]
6. Photodissociation of hydrated hydrogen iodide clusters.
Lee HM; Kolaski M; Kim KS
Chemphyschem; 2008 Mar; 9(4):567-71. PubMed ID: 18286552
[TBL] [Abstract][Full Text] [Related]
7. Ab initio molecular dynamics simulations of an excited state of X(-)(H(2)O)(3) (X = Cl, I) complex.
Kołaski M; Lee HM; Pak C; Dupuis M; Kim KS
J Phys Chem A; 2005 Oct; 109(42):9419-23. PubMed ID: 16866390
[TBL] [Abstract][Full Text] [Related]
8. 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; 129(16):164505. PubMed ID: 19045282
[TBL] [Abstract][Full Text] [Related]
9. 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; 110(4):1438-54. PubMed ID: 16435804
[TBL] [Abstract][Full Text] [Related]
10. Ultrafast charge-transfer-to-solvent dynamics of iodide in tetrahydrofuran. 2. Photoinduced electron transfer to counterions in solution.
Bragg AE; Schwartz BJ
J Phys Chem A; 2008 Apr; 112(16):3530-43. PubMed ID: 18386855
[TBL] [Abstract][Full Text] [Related]
11. Ab initio QM/MM molecular dynamics study on the excited-state hydrogen transfer of 7-azaindole in water solution.
Kina D; Nakayama A; Noro T; Taketsugu T; Gordon MS
J Phys Chem A; 2008 Oct; 112(40):9675-83. PubMed ID: 18785694
[TBL] [Abstract][Full Text] [Related]
12. 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; 110(19):9681-91. PubMed ID: 16686519
[TBL] [Abstract][Full Text] [Related]
13. Hydrated hydride anion clusters.
Lee HM; Kim D; Singh NJ; Kołaski M; Kim KS
J Chem Phys; 2007 Oct; 127(16):164311. PubMed ID: 17979342
[TBL] [Abstract][Full Text] [Related]
14. Microsolvation of the sodium and iodide ions and their ion pair in acetonitrile clusters: a theoretical study.
Nguyen TN; Hughes SR; Peslherbe GH
J Phys Chem B; 2008 Jan; 112(2):621-35. PubMed ID: 18183958
[TBL] [Abstract][Full Text] [Related]
15. Electron hydration dynamics in water clusters: A direct ab initio molecular dynamics approach.
Tachikawa H
J Chem Phys; 2006 Oct; 125(14):144307. PubMed ID: 17042590
[TBL] [Abstract][Full Text] [Related]
16. Structure, dynamics, and reactivity of hydrated electrons by ab initio molecular dynamics.
Marsalek O; Uhlig F; VandeVondele J; Jungwirth P
Acc Chem Res; 2012 Jan; 45(1):23-32. PubMed ID: 21899274
[TBL] [Abstract][Full Text] [Related]
17. Dynamics of charge-transfer-to-solvent precursor states in I- (water)n (n = 3-10) clusters studied with photoelectron imaging.
Kammrath A; Verlet JR; Bragg AE; Griffin GB; Neumark DM
J Phys Chem A; 2005 Dec; 109(50):11475-83. PubMed ID: 16354038
[TBL] [Abstract][Full Text] [Related]
18. Photochemistry of hydrogen halides on water clusters: simulations of electronic spectra and photodynamics, and comparison with photodissociation experiments.
Ončák M; Slavíček P; Fárník M; Buck U
J Phys Chem A; 2011 Jun; 115(23):6155-68. PubMed ID: 21265520
[TBL] [Abstract][Full Text] [Related]
19. Photofragment coincidence imaging of small I-(H2O)n clusters excited to the charge-transfer-to-solvent state.
Szpunar DE; Kautzman KE; Faulhaber AE; Neumark DM
J Chem Phys; 2006 Feb; 124(5):054318. PubMed ID: 16468880
[TBL] [Abstract][Full Text] [Related]
20. Computational studies of aqueous-phase photochemistry and the hydrated electron in finite-size clusters.
Sobolewski AL; Domcke W
Phys Chem Chem Phys; 2007 Aug; 9(29):3818-29. PubMed ID: 17637974
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
