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Journal Abstract Search

239 related items for PubMed ID: 19594123

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  • 2. 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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  • 3. Structures and energetics of H(6)(+) clusters.
    Hao Q, Simmonett AC, Yamaguchi Y, Fang DC, Schaefer HF.
    J Phys Chem A; 2009 Dec 03; 113(48):13608-20. PubMed ID: 19852448
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  • 4. Characterization of the X2A1, A2B1, and X2Pi electronic states of the Ga2H molecule and the X2A' and A 2A" isomerization transition states connecting the three minima.
    Wang H, Wang S, Yan G, Yamaguchi Y, Schaefer HF.
    J Chem Phys; 2006 Jan 28; 124(4):044309. PubMed ID: 16460164
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  • 7. Characterization of singlet ground and low-lying electronic excited states of phosphaethyne and isophosphaethyne.
    Ingels JB, Turney JM, Richardson NA, Yamaguchi Y, Schaefer HF.
    J Chem Phys; 2006 Sep 14; 125(10):104306. PubMed ID: 16999525
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  • 9. Computational investigation of the conrotatory and disrotatory isomerization channels of bicyclo[1.1.0]butane to buta-1,3-diene: a completely renormalized coupled-cluster study.
    Kinal A, Piecuch P.
    J Phys Chem A; 2007 Feb 01; 111(4):734-42. PubMed ID: 17249766
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  • 10. Cis-cis and trans-perp HOONO: action spectroscopy and isomerization kinetics.
    Fry JL, Nizkorodov SA, Okumura M, Roehl CM, Francisco JS, Wennberg PO.
    J Chem Phys; 2004 Jul 15; 121(3):1432-48. PubMed ID: 15260688
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  • 12. Born-Oppenheimer symmetry breaking in the C state of NO2: importance of static and dynamic correlation effects.
    Bera PP, Yamaguchi Y, Schaefer HF, Crawford TD.
    J Phys Chem A; 2008 Mar 27; 112(12):2669-76. PubMed ID: 18311948
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  • 18. Computational studies on the ground and excited states of BrOOBr.
    Li Y, Vo CK.
    J Chem Phys; 2006 May 28; 124(20):204309. PubMed ID: 16774334
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  • 19. Coupled cluster investigation on the low-lying electronic states of CuCN and CuNC and the ground state barrier to isomerization.
    Paul A, Yamaguchi Y, Schaefer HF.
    J Chem Phys; 2007 Oct 21; 127(15):154324. PubMed ID: 17949166
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  • 20. The diazocarbene (CNN) molecule: characterization of the X 3Sigma- and A 3Pi electronic states.
    Yamaguchi Y, Schaefer HF.
    J Chem Phys; 2004 May 22; 120(20):9536-46. PubMed ID: 15267965
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