These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


Pubmed for Handhelds

PUBMED FOR HANDHELDS

Journal Abstract Search

538 related items for PubMed ID: 18715053

  • 1. Density functional restricted-unrestricted approach for nonlinear properties: application to electron paramagnetic resonance parameters of square planar copper complexes.
    Rinkevicius Z, de Almeida KJ, Vahtras O.
    J Chem Phys; 2008 Aug 14; 129(6):064109. PubMed ID: 18715053
    [Abstract] [Full Text] [Related]

  • 2.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 3. Computational studies of electron paramagnetic resonance parameters for paramagnetic molybdenum complexes. 1. Method validation on small and medium-sized systems.
    Fritscher J, Hrobarik P, Kaupp M.
    J Phys Chem B; 2007 May 03; 111(17):4616-29. PubMed ID: 17408258
    [Abstract] [Full Text] [Related]

  • 4. A density functional study of the electronic structure and spin Hamiltonian parameters of mononuclear thiomolybdenyl complexes.
    Drew SC, Young CG, Hanson GR.
    Inorg Chem; 2007 Apr 02; 46(7):2388-97. PubMed ID: 17305330
    [Abstract] [Full Text] [Related]

  • 5.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 6.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 7.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 8. Calculating the electron paramagnetic resonance parameters of exchange coupled transition metal complexes using broken symmetry density functional theory: application to a MnIII/MnIV model compound.
    Sinnecker S, Neese F, Noodleman L, Lubitz W.
    J Am Chem Soc; 2004 Mar 03; 126(8):2613-22. PubMed ID: 14982471
    [Abstract] [Full Text] [Related]

  • 9. Density functional study of electron paramagnetic resonance parameters and spin density distributions of dicopper(I) complexes with bridging azo and tetrazine radical-anion ligands.
    Remenyi C, Reviakine R, Kaupp M.
    J Phys Chem A; 2006 Mar 23; 110(11):4021-33. PubMed ID: 16539425
    [Abstract] [Full Text] [Related]

  • 10.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 11.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 12.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 13. The effect of spin polarization on zero field splitting parameters in paramagnetic pi-electron molecules.
    van Gastel M.
    J Chem Phys; 2009 Sep 28; 131(12):124111. PubMed ID: 19791856
    [Abstract] [Full Text] [Related]

  • 14.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 15. Relativistic spin-orbit effects on hyperfine coupling tensors by density-functional theory.
    Arbuznikov AV, Vaara J, Kaupp M.
    J Chem Phys; 2004 Feb 01; 120(5):2127-39. PubMed ID: 15268351
    [Abstract] [Full Text] [Related]

  • 16. Ligand-derived oxidase activity. Catalytic aerial oxidation of alcohols (including methanol) by Cu(II)-diradical complexes.
    Mukherjee C, Pieper U, Bothe E, Bachler V, Bill E, Weyhermüller T, Chaudhuri P.
    Inorg Chem; 2008 Oct 06; 47(19):8943-56. PubMed ID: 18754615
    [Abstract] [Full Text] [Related]

  • 17. Origin of the zero-field splitting in mononuclear octahedral dihalide MnII complexes: an investigation by multifrequency high-field electron paramagnetic resonance and density functional theory.
    Duboc C, Phoeung T, Zein S, Pécaut J, Collomb MN, Neese F.
    Inorg Chem; 2007 Jun 11; 46(12):4905-16. PubMed ID: 17508742
    [Abstract] [Full Text] [Related]

  • 18.
    ; . PubMed ID:
    [No Abstract] [Full Text] [Related]

  • 19. Comparative density-functional study of the electron paramagnetic resonance parameters of amavadin.
    Remenyi C, Munzarova ML, Kaupp M.
    J Phys Chem B; 2005 Mar 10; 109(9):4227-33. PubMed ID: 16851485
    [Abstract] [Full Text] [Related]

  • 20. DFT analysis of g and 13C hyperfine coupling tensors for model Ni(I)(CO)(n)L(m) (n = 1-4, L = H2O, OH-) complexes epitomizing surface nickel(I) carbonyls.
    Pietrzyk P, Podolska K, Sojka Z.
    J Phys Chem A; 2008 Nov 27; 112(47):12208-19. PubMed ID: 18986126
    [Abstract] [Full Text] [Related]

    Page: [Next] [New Search]
    of 27.