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Journal Abstract Search

2229 related items for PubMed ID: 19371124

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  • 3. Interpolating moving least-squares methods for fitting potential energy surfaces: an application to the H2CN unimolecular reaction.
    Guo Y, Harding LB, Wagner AF, Minkoff M, Thompson DL.
    J Chem Phys; 2007 Mar 14; 126(10):104105. PubMed ID: 17362059
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  • 4. Potential-energy surface for the electronic ground state of NH3 up to 20,000 cm-1 above equilibrium.
    Yurchenko SN, Zheng J, Lin H, Jensen P, Thiel W.
    J Chem Phys; 2005 Oct 01; 123(13):134308. PubMed ID: 16223289
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  • 8. High-level ab initio potential energy surfaces and vibrational energies of H2CS.
    Yachmenev A, Yurchenko SN, Ribeyre T, Thiel W.
    J Chem Phys; 2011 Aug 21; 135(7):074302. PubMed ID: 21861565
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  • 9. A classical trajectory study of the intramolecular dynamics, isomerization, and unimolecular dissociation of HO2.
    Perry JW, Dawes R, Wagner AF, Thompson DL.
    J Chem Phys; 2013 Aug 28; 139(8):084319. PubMed ID: 24007009
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  • 10. Interpolating moving least-squares methods for fitting potential energy surfaces: a strategy for efficient automatic data point placement in high dimensions.
    Dawes R, Thompson DL, Wagner AF, Minkoff M.
    J Chem Phys; 2008 Feb 28; 128(8):084107. PubMed ID: 18315033
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  • 11. Ab initio potential energy and dipole moment surfaces of (H2O)2.
    Huang X, Braams BJ, Bowman JM.
    J Phys Chem A; 2006 Jan 19; 110(2):445-51. PubMed ID: 16405316
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  • 16. Interpolating moving least-squares methods for fitting potential energy surfaces: Improving efficiency via local approximants.
    Guo Y, Tokmakov I, Thompson DL, Wagner AF, Minkoff M.
    J Chem Phys; 2007 Dec 07; 127(21):214106. PubMed ID: 18067348
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  • 18. Vibration energy levels of the PH3, PH2D, and PHD2 molecules calculated from high order potential energy surface.
    Nikitin AV, Holka F, Tyuterev VG, Fremont J.
    J Chem Phys; 2009 Jun 28; 130(24):244312. PubMed ID: 19566158
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  • 19. Anharmonic force field and vibrational dynamics of CH2F2 up to 5000 cm(-1) studied by Fourier transform infrared spectroscopy and state-of-the-art ab initio calculations.
    Tasinato N, Regini G, Stoppa P, Pietropolli Charmet A, Gambi A.
    J Chem Phys; 2012 Jun 07; 136(21):214302. PubMed ID: 22697538
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