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Journal Abstract Search

666 related items for PubMed ID: 18688365

  • 21. Supersonically cooled hydronium ions in a slit-jet discharge: high-resolution infrared spectroscopy and tunneling dynamics of HD2O+.
    Dong F, Uy D, Davis S, Child M, Nesbitt DJ.
    J Chem Phys; 2005 Jun 08; 122(22):224301. PubMed ID: 15974662
    [Abstract] [Full Text] [Related]

  • 22. Ground-state and vibrationally assisted tunneling in the formic acid dimer.
    Mil'nikov GV, Kühn O, Nakamura H.
    J Chem Phys; 2005 Aug 15; 123(7):074308. PubMed ID: 16229571
    [Abstract] [Full Text] [Related]

  • 23. Analysis of the FASSST rotational spectrum of NCNCS in view of quantum monodromy.
    Winnewisser BP, Winnewisser M, Medvedev IR, De Lucia FC, Ross SC, Koput J.
    Phys Chem Chem Phys; 2010 Aug 01; 12(29):8158-89. PubMed ID: 20372691
    [Abstract] [Full Text] [Related]

  • 24. High-resolution infrared spectroscopy in the 1,200-1,300 cm(-1) region and accurate theoretical estimates for the structure and ring-puckering barrier of perfluorocyclobutane.
    Blake TA, Glendening ED, Sams RL, Sharpe SW, Xantheas SS.
    J Phys Chem A; 2007 Nov 08; 111(44):11328-41. PubMed ID: 17616110
    [Abstract] [Full Text] [Related]

  • 25. A quantum equation of motion for chemical reaction systems on an adiabatic double-well potential surface in solution based on the framework of mixed quantum-classical molecular dynamics.
    Yamada A, Okazaki S.
    J Chem Phys; 2008 Jan 28; 128(4):044507. PubMed ID: 18247969
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  • 26. Bound states of the OH(2Pi)-HCl complex on ab initio diabatic potentials.
    Groenenboom GC, Fishchuk AV, van der Avoird A.
    J Chem Phys; 2009 Sep 28; 131(12):124307. PubMed ID: 19791881
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  • 27. Multistate vibronic interactions in difluorobenzene radical cations. II. Quantum dynamical simulations.
    Faraji S, Meyer HD, Köppel H.
    J Chem Phys; 2008 Aug 21; 129(7):074311. PubMed ID: 19044771
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  • 28. 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
    [Abstract] [Full Text] [Related]

  • 29. Large-amplitude quantum mechanics in polyatomic hydrides. II. A particle-on-a-sphere model for XH(n) (n=4,5).
    Deskevich MP, McCoy AB, Hutson JM, Nesbitt DJ.
    J Chem Phys; 2008 Mar 07; 128(9):094306. PubMed ID: 18331092
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  • 30. Molecular structure, vinyl rotation barrier, and vibrational dynamics of 2,6-dichlorostyrene. A theoretical and experimental research.
    Ceacero-Vega AA, Ruiz TP, Gómez MF, Roldán JM, Navarro A, Fernández-Liencres MP, Jayasooriya UA.
    J Phys Chem A; 2007 Jul 19; 111(28):6406-19. PubMed ID: 17591757
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  • 31. Acceptor tunneling motion and O-H stretching vibration overtones of the water dimer.
    Hänninen V, Salmi T, Halonen L.
    J Phys Chem A; 2009 Jun 25; 113(25):7133-7. PubMed ID: 19489600
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  • 32. CVRQD ab initio ground-state adiabatic potential energy surfaces for the water molecule.
    Barletta P, Shirin SV, Zobov NF, Polyansky OL, Tennyson J, Valeev EF, Császár AG.
    J Chem Phys; 2006 Nov 28; 125(20):204307. PubMed ID: 17144700
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  • 33. Analytic Morse/long-range potential energy surfaces and predicted infrared spectra for CO2-H2.
    Li H, Roy PN, Le Roy RJ.
    J Chem Phys; 2010 Jun 07; 132(21):214309. PubMed ID: 20528024
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  • 34. Multiconfigurational time-dependent Hartree calculations for tunneling splittings of vibrational states: Theoretical considerations and application to malonaldehyde.
    Hammer T, Coutinho-Neto MD, Viel A, Manthe U.
    J Chem Phys; 2009 Dec 14; 131(22):224109. PubMed ID: 20001026
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  • 35. Ab initio rate constants from hyperspherical quantum scattering: application to H+C2H6 and H+CH3OH.
    Kerkeni B, Clary DC.
    J Chem Phys; 2004 Oct 08; 121(14):6809-21. PubMed ID: 15473738
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  • 36. Spectroscopy and Dynamics of Jet-Cooled Polyynes in a Slit Supersonic Discharge: Sub-Doppler Infrared Studies of Diacetylene HCCCCH.
    Chang CH, Nesbitt DJ.
    J Phys Chem A; 2015 Jul 16; 119(28):7940-50. PubMed ID: 25919691
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  • 37. Full-dimensional, ab initio potential energy and dipole moment surfaces for water.
    Wang Y, Shepler BC, Braams BJ, Bowman JM.
    J Chem Phys; 2009 Aug 07; 131(5):054511. PubMed ID: 19673578
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  • 38. Nonadiabatic effects on peptide vibrational dynamics induced by conformational changes.
    Antony J, Schmidt B, Schütte C.
    J Chem Phys; 2005 Jan 01; 122(1):14309. PubMed ID: 15638661
    [Abstract] [Full Text] [Related]

  • 39.
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  • 40. Bound state potential energy surface construction: ab initio zero-point energies and vibrationally averaged rotational constants.
    Bettens RP.
    J Am Chem Soc; 2003 Jan 15; 125(2):584-7. PubMed ID: 12517175
    [Abstract] [Full Text] [Related]

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