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Journal Abstract Search

484 related items for PubMed ID: 18688380

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  • 5. High-level ab initio calculations on HGeCl and the equilibrium geometry of the A1A'' state derived from Franck-Condon analysis of the single-vibronic-level emission spectra of HGeCl and DGeCl.
    Mok DK, Chau FT, Lee EP, Dyke JM.
    J Comput Chem; 2010 Feb; 31(3):476-91. PubMed ID: 19499544
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  • 6. The double Renner effect in the X(2)A" and A(2)A' electronic states of HO(2).
    Melnikov VV, Odaka TE, Jensen P, Hirano T.
    J Chem Phys; 2008 Mar 21; 128(11):114316. PubMed ID: 18361580
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  • 7. Study of the C(3P) + OH(X2Pi) --> CO(a3Pi) + H(2S) reaction: fully global ab initio potential energy surfaces of the 12A'' and 14A'' excited states and non adiabatic couplings.
    Zanchet A, Bussery-Honvault B, Jorfi M, Honvault P.
    Phys Chem Chem Phys; 2009 Aug 07; 11(29):6182-91. PubMed ID: 19606328
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  • 9. Three-dimensional potential energy surface of the Ar-OH(2Pi i) complex.
    Sumiyoshi Y, Funahara I, Sato K, Ohshima Y, Endo Y.
    J Chem Phys; 2006 Sep 28; 125(12):124307. PubMed ID: 17014174
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  • 10. Application of interpolating moving least squares fitting to hypervelocity collision dynamics: O(3P) + HCl.
    Camden JP, Dawes R, Thompson DL.
    J Phys Chem A; 2009 Apr 23; 113(16):4626-30. PubMed ID: 19371121
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  • 11. Intermolecular potential energy surface and spectra of He-HCl with generalization to other rare gas-hydrogen halide complexes.
    Murdachaew G, Szalewicz K, Jiang H, Bacić Z.
    J Chem Phys; 2004 Dec 15; 121(23):11839-55. PubMed ID: 15634146
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  • 12. Accurate double many-body expansion potential energy surface for N3((4)A'') from correlation scaled ab initio energies with extrapolation to the complete basis set limit.
    Galvão BR, Varandas AJ.
    J Phys Chem A; 2009 Dec 31; 113(52):14424-30. PubMed ID: 19681622
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  • 16. Theoretical studies on low-lying electronic states of cyanocarbene HCCN and its ionic states.
    Zhao ZX, Zhang HX, Sun CC.
    J Phys Chem A; 2008 Nov 27; 112(47):12125-31. PubMed ID: 18959399
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  • 17. Rovibrational spectra of LiH2+, LiHD+ and LiD2+ determined from FCI property surfaces.
    Page AJ, von Nagy-Felsobuki EI.
    J Phys Chem A; 2007 May 24; 111(20):4478-88. PubMed ID: 17455917
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  • 19. Low-lying triplet states of diphosphene and diphosphinylidene.
    Lu T, Hao Q, Simmonett AC, Evangelista FA, Yamaguchi Y, Fang DC, Schaefer HF.
    J Phys Chem A; 2010 Oct 14; 114(40):10850-6. PubMed ID: 20836526
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