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Journal Abstract Search

289 related items for PubMed ID: 17402778

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  • 23. Structure of the hydrated and dimethyl sulfoxide solvated rubidium ions in solution.
    D'Angelo P, Persson I.
    Inorg Chem; 2004 May 31; 43(11):3543-9. PubMed ID: 15154820
    [Abstract] [Full Text] [Related]

  • 24. The Jahn-Teller effect of the Cr(2+) ion in aqueous solution: Ab initio QM/MM molecular dynamics simulations.
    Kritayakornupong C.
    J Comput Chem; 2008 Jan 15; 29(1):115-21. PubMed ID: 17551971
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  • 27. Structure and dynamics of phosphate ion in aqueous solution: an ab initio QMCF MD study.
    Pribil AB, Hofer TS, Randolf BR, Rode BM.
    J Comput Chem; 2008 Nov 15; 29(14):2330-4. PubMed ID: 18473325
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  • 28. The hydration structure of Sn(II): an ab initio quantum mechanical charge field molecular dynamics study.
    Lim LH, Hofer TS, Pribil AB, Rode BM.
    J Phys Chem B; 2009 Apr 02; 113(13):4372-8. PubMed ID: 19253986
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  • 29. Structure and dynamics of the CrIII ion in aqueous solution: Ab initio QM/MM molecular dynamics simulation.
    Kritayakornupong C, Plankensteiner K, Rode BM.
    J Comput Chem; 2004 Oct 02; 25(13):1576-83. PubMed ID: 15264252
    [Abstract] [Full Text] [Related]

  • 30. Structural and dynamical properties and vibrational spectra of bisulfate ion in water: a study by Ab initio quantum mechanical charge field molecular dynamics.
    Vchirawongkwin V, Kritayakornupong C, Rode BM.
    J Phys Chem B; 2010 Sep 09; 114(35):11561-9. PubMed ID: 20707370
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  • 32. The stability of bisulfite and sulfonate ions in aqueous solution characterized by hydration structure and dynamics.
    Vchirawongkwin V, Pornpiganon C, Kritayakornupong C, Tongraar A, Rode BM.
    J Phys Chem B; 2012 Sep 20; 116(37):11498-507. PubMed ID: 22920297
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  • 33. Structural and dynamic aspects of hydration of HAsO4(-2): an ab initio QMCF MD simulation.
    Bhattacharjee A, Pribil AB, Lim LH, Hofer TS, Randolf BR, Rode BM.
    J Phys Chem B; 2010 Mar 25; 114(11):3921-6. PubMed ID: 20192170
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  • 35. A QMCF-MD investigation of the structure and dynamics of Ce4+ in aqueous solution.
    Lutz OM, Hofer TS, Randolf BR, Weiss AK, Rode BM.
    Inorg Chem; 2012 Jun 18; 51(12):6746-52. PubMed ID: 22651096
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  • 36. Sulfur dioxide in water: structure and dynamics studied by an ab initio quantum mechanical charge field molecular dynamics simulation.
    Moin ST, Lim LH, Hofer TS, Randolf BR, Rode BM.
    Inorg Chem; 2011 Apr 18; 50(8):3379-86. PubMed ID: 21417290
    [Abstract] [Full Text] [Related]

  • 37. Local order in aqueous NaCl solutions and pure water: X-ray scattering and molecular dynamics simulations study.
    Bouazizi S, Nasr S, Jaîdane N, Bellissent-Funel MC.
    J Phys Chem B; 2006 Nov 23; 110(46):23515-23. PubMed ID: 17107207
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  • 39. An extended ab initio QM/MM MD approach to structure and dynamics of Zn(II) in aqueous solution.
    Fatmi MQ, Hofer TS, Randolf BR, Rode BM.
    J Chem Phys; 2005 Aug 01; 123(5):054514. PubMed ID: 16108676
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