These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

281 related articles for article (PubMed ID: 15836378)

  • 1. Dynamical hydrogen atom tunneling in dichlorotropolone: a combined quantum, semiclassical, and classical study.
    Giese K; Ushiyama H; Takatsuka K; Kühn O
    J Chem Phys; 2005 Mar; 122(12):124307. PubMed ID: 15836378
    [TBL] [Abstract][Full Text] [Related]  

  • 2. The all-Cartesian reaction plane Hamiltonian: formulation and application to the H-atom transfer in tropolone.
    Giese K; Kühn O
    J Chem Phys; 2005 Aug; 123(5):054315. PubMed ID: 16108647
    [TBL] [Abstract][Full Text] [Related]  

  • 3. 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; 130(23):234305. PubMed ID: 19548725
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Full-dimensional quantum calculations of ground-state tunneling splitting of malonaldehyde using an accurate ab initio potential energy surface.
    Wang Y; Braams BJ; Bowman JM; Carter S; Tew DP
    J Chem Phys; 2008 Jun; 128(22):224314. PubMed ID: 18554020
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Importance of anharmonicity, recrossing effects, and quantum mechanical tunneling in transition state theory with semiclassical tunneling. A test case: the H2 + Cl hydrogen abstraction reaction.
    Sansón JA; Sánchez ML; Corchado JC
    J Phys Chem A; 2006 Jan; 110(2):589-99. PubMed ID: 16405331
    [TBL] [Abstract][Full Text] [Related]  

  • 6. An exploration of electronic structure and nuclear dynamics in tropolone: II. The A (1)B2 (pi* pi) excited state.
    Burns LA; Murdock D; Vaccaro PH
    J Chem Phys; 2009 Apr; 130(14):144304. PubMed ID: 19368442
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Mode-specific tunneling dynamics in the ground electronic state of tropolone.
    Murdock D; Burns LA; Vaccaro PH
    J Chem Phys; 2007 Aug; 127(8):081101. PubMed ID: 17764221
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Multidimensional spectra via the mixed quantum-classical Liouville method: signatures of nonequilibrium dynamics.
    Hanna G; Geva E
    J Phys Chem B; 2009 Jul; 113(27):9278-88. PubMed ID: 19530666
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Near-UV photolysis of substituted phenols, I: 4-fluoro-, 4-chloro- and 4-bromophenol.
    Devine AL; Nix MG; Cronin B; Ashfold MN
    Phys Chem Chem Phys; 2007 Jul; 9(28):3749-62. PubMed ID: 17622410
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Strange Kinetics of the C(2)H(6) + CN Reaction Explained.
    Georgievskii Y; Klippenstein SJ
    J Phys Chem A; 2007 May; 111(19):3802-11. PubMed ID: 17388379
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Reduced-dimensional quantum approach to tunneling splittings using saddle-point normal coordinates.
    Kamarchik E; Wang Y; Bowman J
    J Phys Chem A; 2009 Jul; 113(26):7556-62. PubMed ID: 19552477
    [TBL] [Abstract][Full Text] [Related]  

  • 12. High-resolution infrared spectroscopy of jet-cooled vinyl radical: symmetric CH2 stretch excitation and tunneling dynamics.
    Dong F; Roberts M; Nesbitt DJ
    J Chem Phys; 2008 Jan; 128(4):044305. PubMed ID: 18247947
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Full-dimensional (15-dimensional) quantum-dynamical simulation of the protonated water dimer. I. Hamiltonian setup and analysis of the ground vibrational state.
    Vendrell O; Gatti F; Lauvergnat D; Meyer HD
    J Chem Phys; 2007 Nov; 127(18):184302. PubMed ID: 18020634
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Full dimensional time-dependent quantum dynamics study of the H + NH3 --> H2 + NH2 reaction.
    Yang M
    J Chem Phys; 2008 Aug; 129(6):064315. PubMed ID: 18715077
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Time-dependent probability of quantum tunneling in terms of the quasisemiclassical method.
    Ushiyama H; Takatsuka K
    J Chem Phys; 2004 Mar; 120(10):4561-72. PubMed ID: 15267315
    [TBL] [Abstract][Full Text] [Related]  

  • 16. High-resolution studies of tropolone in the S0 and S1 electronic states: isotope driven dynamics in the zero-point energy levels.
    Keske JC; Lin W; Pringle WC; Novick SE; Blake TA; Plusquellic DF
    J Chem Phys; 2006 Feb; 124(7):74309. PubMed ID: 16497038
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Vibrational energy relaxation of polyatomic molecules in liquid solution via the linearized semiclassical method.
    Ka BJ; Geva E
    J Phys Chem A; 2006 Aug; 110(31):9555-67. PubMed ID: 16884188
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Quantum tunneling in the midrange vibrational fundamentals of tropolone.
    Redington RL; Redington TE; Sams RL
    J Phys Chem A; 2006 Aug; 110(31):9633-42. PubMed ID: 16884197
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Wave function delocalization and large-amplitude vibrations of helium on corrugated aromatic microsurfaces: tetracene.He and pentacene.He van der Waals complexes.
    Xu M; Bacić Z
    J Phys Chem A; 2007 Aug; 111(31):7653-63. PubMed ID: 17530836
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Exploring excited-state hydrogen atom transfer along an ammonia wire cluster: competitive reaction paths and vibrational mode selectivity.
    Tanner C; Manca C; Leutwyler S
    J Chem Phys; 2005 May; 122(20):204326. PubMed ID: 15945743
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 15.