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Journal Abstract Search

200 related items for PubMed ID: 16480300

  • 1. A combined density functional theory and coupled cluster method investigation of the structural properties and stabilities of radical CH(2)CP and its isomers.
    Yu HT, Li MX, Han KL.
    J Phys Chem A; 2006 Feb 23; 110(7):2411-20. PubMed ID: 16480300
    [Abstract] [Full Text] [Related]

  • 2. Si2CN: a stable nitrogen-containing radical with cyclic ground state.
    Chen GH, Ding YH, Huang XR, Yu JK, Sun CC.
    J Chem Phys; 2004 May 08; 120(18):8512-20. PubMed ID: 15267777
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  • 3. Theoretical prediction regarding structural and thermodynamical characteristics of stable CH3PO2 isomers and unimolecular decomposition mechanisms of species CH3P(=O)2, CH3O-P=O, and CH2=P(=O)OH.
    Kan W, Zhong H, Yu HT.
    J Comput Chem; 2009 Nov 15; 30(14):2334-50. PubMed ID: 19350573
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  • 5. Theoretical study on structures and stability of C4P isomers.
    Yu GT, Ding YH, Huang XR, Sun CC.
    J Phys Chem A; 2005 Mar 03; 109(8):1594-602. PubMed ID: 16833482
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  • 6. Monosilicon-substituted cyanoacetylene: a computational study.
    Yang LM, Ding YH, Wang Q, Sun CC.
    J Comput Chem; 2006 Apr 15; 27(5):578-95. PubMed ID: 16470670
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  • 10. Theoretical study on structures and stability of Si2CP isomers.
    Chen GH, Ding YH, Huang XR, Sun CC.
    J Phys Chem A; 2005 Jun 30; 109(25):5619-24. PubMed ID: 16833894
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  • 11. Water dimer radical cation: structures, vibrational frequencies, and energetics.
    Cheng Q, Evangelista FA, Simmonett AC, Yamaguchi Y, Schaefer HF.
    J Phys Chem A; 2009 Dec 10; 113(49):13779-89. PubMed ID: 19891464
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  • 12. Mono- and dibridged isomers of Si2H3 and Si2H4: the true ground state global minima. Theory and experiment in concert.
    Sari L, McCarthy MC, Schaefer HF, Thaddeus P.
    J Am Chem Soc; 2003 Sep 17; 125(37):11409-17. PubMed ID: 16220964
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  • 14. Combined DFT, QCISD(T), and G2 mechanism investigation for the reactions of carbon monophosphide CP with unsaturated hydrocarbons allene CH2CCH2 and methylacetylene CH3CCH.
    Zhao YL, Kan W, Zhong H, Yu HT, Fu HG.
    J Comput Chem; 2007 May 17; 28(7):1221-33. PubMed ID: 17299769
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  • 17. Do penta- and decaphospha analogues of lithocene anion and beryllocene exist? Analysis of stability, structure, and bonding by hybrid density functional study.
    Malar EJ.
    Inorg Chem; 2003 Jun 16; 42(12):3873-83. PubMed ID: 12793825
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  • 19. Ab initio and direct dynamics studies of the reaction of singlet methylene with acetylene and the lifetime of the cyclopropene complex.
    Yu HG, Muckerman JT.
    J Phys Chem A; 2005 Mar 10; 109(9):1890-6. PubMed ID: 16833521
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