Articles producció científicaQuímica Física i Inorgànica

Interplay between Local Anisotropies in Binuclear Complexes

  • Dades identificatives

    Identificador:  imarina:9437734
    Autors:  Ruamps, Renaud; Maurice, Remi; de Graaf, Coen; Guihery, Nathalie
    Resum:
    A systematic study has been undertaken to determine how local distortions affect the overall (molecular) magnetic anisotropies in binuclear complexes. For this purpose we have applied a series of distortions to two binuclear Ni(II) model complexes and extracted the magnetic anisotropy parameters of multispin and giant-spin model Hamiltonians. Furthermore, local and molecular magnetic axes frames have been determined. It is shown that certain combinations of local distortions can lead to constructive interference of the local anisotropies and that the largest contribution to the anisotropic exchange does not arise from the second-rank tensor normally included in the multispin Hamiltonian, but rather from a fourth-rank tensor. From the comparison of the extracted parameters, simple rules are obtained to maximize the molecular anisotropy by controlling the local magnetic anisotropy, which opens the way to tune the anisotropy in binuclear or polynuclear complexes.
  • Altres:

    Enllaç font original: https://pubs.acs.org/doi/10.1021/ic500180k
    Referència de l'ítem segons les normes APA: Ruamps, Renaud; Maurice, Remi; de Graaf, Coen; Guihery, Nathalie (2014). Interplay between Local Anisotropies in Binuclear Complexes. Inorganic Chemistry, 53(9), 4508-4516. DOI: 10.1021/ic500180k
    Referència a l'article segons font original: Inorganic Chemistry. 53 (9): 4508-4516
    DOI de l'article: 10.1021/ic500180k
    Any de publicació de la revista: 2014
    Entitat: Universitat Rovira i Virgili
    Versió de l'article dipositat: info:eu-repo/semantics/acceptedVersion
    Data d'alta del registre: 2025-02-17
    Autor/s de la URV: De Graaf, Cornelis
    Departament: Química Física i Inorgànica
    URL Document de llicència: https://repositori.urv.cat/ca/proteccio-de-dades/
    Tipus de publicació: Journal Publications
    Autor segons l'article: Ruamps, Renaud; Maurice, Remi; de Graaf, Coen; Guihery, Nathalie
    Accès a la llicència d'ús: https://creativecommons.org/licenses/by/3.0/es/
    Àrees temàtiques: Química, Physical and theoretical chemistry, Medicina i, Materiais, Interdisciplinar, Inorganic chemistry, General medicine, Farmacia, Engenharias iii, Engenharias ii, Engenharias i, Ciências biológicas iii, Ciências biológicas ii, Ciências biológicas i, Ciências agrárias i, Chemistry, inorganic & nuclear, Chemistry (miscellaneous), Biotecnología, Astronomia / física
    Adreça de correu electrònic de l'autor: coen.degraaf@urv.cat
  • Paraules clau:

    Molecules
    Magnetic-anisotropy
    Chemistry
    Chemistr
    Chemistry (Miscellaneous)
    Inorganic & Nuclear
    Inorganic Chemistry
    Physical and Theoretical Chemistry
    Química
    Medicina i
    Materiais
    Interdisciplinar
    General medicine
    Farmacia
    Engenharias iii
    Engenharias ii
    Engenharias i
    Ciências biológicas iii
    Ciências biológicas ii
    Ciências biológicas i
    Ciências agrárias i
    Biotecnología
    Astronomia / física
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