314 related articles for article (PubMed ID: 19780519)
1. Quantum dynamics of the ultrafast pi pi*/n pi* population transfer in uracil and 5-fluoro-uracil in water and acetonitrile.
Improta R; Barone V; Lami A; Santoro F
J Phys Chem B; 2009 Oct; 113(43):14491-503. PubMed ID: 19780519
[TBL] [Abstract][Full Text] [Related]
2. Solvent effect on the singlet excited-state lifetimes of nucleic acid bases: A computational study of 5-fluorouracil and uracil in acetonitrile and water.
Santoro F; Barone V; Gustavsson T; Improta R
J Am Chem Soc; 2006 Dec; 128(50):16312-22. PubMed ID: 17165786
[TBL] [Abstract][Full Text] [Related]
3. Solvent effect on the singlet excited-state dynamics of 5-fluorouracil in acetonitrile as compared with water.
Gustavsson T; Sarkar N; Lazzarotto E; Markovitsi D; Barone V; Improta R
J Phys Chem B; 2006 Jul; 110(26):12843-7. PubMed ID: 16805579
[TBL] [Abstract][Full Text] [Related]
4. 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]
5. Absorption and fluorescence spectra of uracil in the gas phase and in aqueous solution: a TD-DFT quantum mechanical study.
Improta R; Barone V
J Am Chem Soc; 2004 Nov; 126(44):14320-1. PubMed ID: 15521728
[TBL] [Abstract][Full Text] [Related]
6. The decay from the dark npi* excited state in uracil: an integrated CASPT2/CASSCF and PCM/TD-DFT study in the gas phase and in water.
Mercier Y; Santoro F; Reguero M; Improta R
J Phys Chem B; 2008 Sep; 112(35):10769-72. PubMed ID: 18700794
[TBL] [Abstract][Full Text] [Related]
7. 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]
8. Solvent-induced shifts in electronic spectra of uracil.
DeFusco A; Ivanic J; Schmidt MW; Gordon MS
J Phys Chem A; 2011 May; 115(18):4574-82. PubMed ID: 21491886
[TBL] [Abstract][Full Text] [Related]
9. Dynamics of ultrafast intramolecular charge transfer with 1-tert-butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) in n-hexane and acetonitrile.
Druzhinin SI; Kovalenko SA; Senyushkina T; Zachariasse KA
J Phys Chem A; 2007 Dec; 111(50):12878-90. PubMed ID: 18034465
[TBL] [Abstract][Full Text] [Related]
10. Ab initio investigation of the methylation and hydration effects on the electronic spectra of uracil and thymine.
Etinski M; Marian CM
Phys Chem Chem Phys; 2010 May; 12(19):4915-23. PubMed ID: 20445899
[TBL] [Abstract][Full Text] [Related]
11. Electronic-structure and quantum dynamical study of the photochromism of the aromatic Schiff base salicylideneaniline.
Ortiz-Sánchez JM; Gelabert R; Moreno M; Lluch JM
J Chem Phys; 2008 Dec; 129(21):214308. PubMed ID: 19063562
[TBL] [Abstract][Full Text] [Related]
12. Intersystem crossing and characterization of dark states in the pyrimidine nucleobases uracil, thymine, and 1-methylthymine.
Etinski M; Fleig T; Marian CM
J Phys Chem A; 2009 Oct; 113(43):11809-16. PubMed ID: 19670894
[TBL] [Abstract][Full Text] [Related]
13. Spectral shifts of the n → π* and π → π* transitions of uracil based on a modified form of solvent reorganization energy.
Ren HS; Li YK; Zhu Q; Zhu J; Li XY
Phys Chem Chem Phys; 2012 Oct; 14(38):13284-91. PubMed ID: 22918130
[TBL] [Abstract][Full Text] [Related]
14. Theoretical study of chlorophyll a hydrates formation in aqueous organic solvents.
Ben Fredj A; Ruiz-López MF
J Phys Chem B; 2010 Jan; 114(1):681-7. PubMed ID: 20020703
[TBL] [Abstract][Full Text] [Related]
15. 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]
16. Ab initio molecular dynamics and time-resolved photoelectron spectroscopy of electronically excited uracil and thymine.
Hudock HR; Levine BG; Thompson AL; Satzger H; Townsend D; Gador N; Ullrich S; Stolow A; Martínez TJ
J Phys Chem A; 2007 Aug; 111(34):8500-8. PubMed ID: 17685594
[TBL] [Abstract][Full Text] [Related]
17. Theoretical study on the mechanism of low-energy dissociative electron attachment for uracil.
Takayanagi T; Asakura T; Motegi H
J Phys Chem A; 2009 Apr; 113(16):4795-801. PubMed ID: 19067567
[TBL] [Abstract][Full Text] [Related]
18. Singlet excited-state behavior of uracil and thymine in aqueous solution: a combined experimental and computational study of 11 uracil derivatives.
Gustavsson T; Bányász A; Lazzarotto E; Markovitsi D; Scalmani G; Frisch MJ; Barone V; Improta R
J Am Chem Soc; 2006 Jan; 128(2):607-19. PubMed ID: 16402849
[TBL] [Abstract][Full Text] [Related]
19. A Monte Carlo-quantum mechanics study of the lowest n-pi* and pi-pi* states of uracil in water.
Ludwig V; Coutinho K; Canuto S
Phys Chem Chem Phys; 2007 Sep; 9(35):4907-12. PubMed ID: 17912421
[TBL] [Abstract][Full Text] [Related]
20. 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]
[Next] [New Search]
