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Journal Abstract Search

276 related items for PubMed ID: 15836311

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  • 2. The ab initio limit quartic force field of BH3.
    Schuurman MS, Allen WD, Schaefer HF.
    J Comput Chem; 2005 Aug; 26(11):1106-12. PubMed ID: 15934063
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  • 3. Thermochemistry of the HOSO radical, a key intermediate in fossil fuel combustion.
    Wheeler SE, Schaefer HF.
    J Phys Chem A; 2009 Jun 18; 113(24):6779-88. PubMed ID: 19459665
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  • 5. Characterization of the HSiN_HNSi system in its electronic ground state.
    Lind MC, Pickard FC, Ingels JB, Paul A, Yamaguchi Y, Schaefer HF.
    J Chem Phys; 2009 Mar 14; 130(10):104301. PubMed ID: 19292528
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  • 6. In search of definitive signatures of the elusive NCCO radical.
    Simmonett AC, Evangelista FA, Allen WD, Schaefer HF.
    J Chem Phys; 2007 Jul 07; 127(1):014306. PubMed ID: 17627345
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  • 8. Toward subchemical accuracy in computational thermochemistry: focal point analysis of the heat of formation of NCO and [H,N,C,O] isomers.
    Schuurman MS, Muir SR, Allen WD, Schaefer HF.
    J Chem Phys; 2004 Jun 22; 120(24):11586-99. PubMed ID: 15268193
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  • 11. Ab initio and density functional theory reinvestigation of gas-phase sulfuric acid monohydrate and ammonium hydrogen sulfate.
    Kurtén T, Sundberg MR, Vehkamäki H, Noppel M, Blomqvist J, Kulmala M.
    J Phys Chem A; 2006 Jun 08; 110(22):7178-88. PubMed ID: 16737269
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  • 14. Accurate ab initio determination of spectroscopic and thermochemical properties of mono- and dichlorocarbenes.
    Tarczay G, Miller TA, Czakó G, Császár AG.
    Phys Chem Chem Phys; 2005 Aug 07; 7(15):2881-93. PubMed ID: 16189607
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  • 15. Ab initio molecular geometry and anharmonic vibrational spectra of thiourea and thiourea-d4.
    Kowal AT.
    J Comput Chem; 2011 Mar 07; 32(4):718-29. PubMed ID: 20925086
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