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Journal Abstract Search

164 related items for PubMed ID: 15836219

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  • 2. Theoretical characterization of dihydrogen adducts with halide anions.
    Vitillo JG, Damin A, Zecchina A, Ricchiardi G.
    J Chem Phys; 2006 Jun 14; 124(22):224308. PubMed ID: 16784275
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  • 5. Ab initio study of hydrogen-bond formation between aliphatic and phenolic hydroxy groups and selected amino acid side chains.
    Nagy PI, Erhardt PW.
    J Phys Chem A; 2008 May 08; 112(18):4342-54. PubMed ID: 18373368
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  • 7. Ab initio calculations on halogen-bonded complexes and comparison with density functional methods.
    Lu YX, Zou JW, Fan JC, Zhao WN, Jiang YJ, Yu QS.
    J Comput Chem; 2009 Apr 15; 30(5):725-32. PubMed ID: 18727160
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  • 8. Estimated MP2 and CCSD(T) interaction energies of n-alkane dimers at the basis set limit: comparison of the methods of Helgaker et al. and Feller.
    Tsuzuki S, Honda K, Uchimaru T, Mikami M.
    J Chem Phys; 2006 Mar 21; 124(11):114304. PubMed ID: 16555885
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  • 9. On geometries of stacked and H-bonded nucleic acid base pairs determined at various DFT, MP2, and CCSD(T) levels up to the CCSD(T)/complete basis set limit level.
    Dabkowska I, Jurecka P, Hobza P.
    J Chem Phys; 2005 May 22; 122(20):204322. PubMed ID: 15945739
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  • 11. Ab initio potential energy and dipole moment surfaces of (H2O)2.
    Huang X, Braams BJ, Bowman JM.
    J Phys Chem A; 2006 Jan 19; 110(2):445-51. PubMed ID: 16405316
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  • 12. 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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  • 13. Ab initio study of the isomeric equilibrium of the HCN...H2O and H2O...HCN hydrogen-bonded clusters.
    Malaspina T, Fileti EE, Riveros JM, Canuto S.
    J Phys Chem A; 2006 Aug 31; 110(34):10303-8. PubMed ID: 16928122
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  • 17. Isomers of the uracil dimer: an ab initio benchmark study.
    Frey JA, Müller A, Losada M, Leutwyler S.
    J Phys Chem B; 2007 Apr 05; 111(13):3534-42. PubMed ID: 17388514
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  • 18. Accurate ab initio binding energies of alkaline earth metal clusters.
    Lee JS.
    J Phys Chem A; 2005 Dec 29; 109(51):11927-32. PubMed ID: 16366644
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