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Journal Abstract Search

371 related items for PubMed ID: 20925086

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  • 9. Fast vibrational configuration interaction using generalized curvilinear coordinates and self-consistent basis.
    Scribano Y, Lauvergnat DM, Benoit DM.
    J Chem Phys; 2010 Sep 07; 133(9):094103. PubMed ID: 20831311
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  • 10. The highly anharmonic BH5 potential energy surface characterized in the ab initio limit.
    Schuurman MS, Allen WD, Schleyer Pv, Schaefer HF.
    J Chem Phys; 2005 Mar 08; 122(10):104302. PubMed ID: 15836311
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  • 15. Pseudo-Jahn-Teller origin of the low barrier hydrogen bond in N(2)H(7) (+).
    García-Fernández P, García-Canales L, García-Lastra JM, Junquera J, Moreno M, Aramburu JA.
    J Chem Phys; 2008 Sep 28; 129(12):124313. PubMed ID: 19045029
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  • 16. Study of the thymine molecule: equilibrium structure from joint analysis of gas-phase electron diffraction and microwave data and assignment of vibrational spectra using results of ab initio calculations.
    Vogt N, Khaikin LS, Grikina OE, Rykov AN, Vogt J.
    J Phys Chem A; 2008 Aug 21; 112(33):7662-70. PubMed ID: 18665577
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  • 18. Ab initio molecular-orbital study of structures and energetics of Si3H3 neutral and anion.
    Saitoh T, Naoe T, Ikuta S.
    J Chem Phys; 2005 May 22; 122(20):204314. PubMed ID: 15945731
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