Tesis doctorals> Departament de Química

The calculation of the thermal dependency of the magnetic susceptibility in extended systems with ab initio electronic structure parameters

  • Identification data

    Identifier: TDX:908
    Handle: http://hdl.handle.net/20.500.11797/TDX908

  • Authors:

    Negodaev, Igor

  • Others:

    Date: 2011-02-18
    Departament/Institute: Departament de Química Física i Inorgànica Universitat Rovira i Virgili.
    Language: eng
    Identifier: urn:isbn:9788469421710 http://hdl.handle.net/10803/31934
    Source: TDX (Tesis Doctorals en Xarxa)
    Author: Negodaev, Igor
    Director: Caballol Lorenzo, Rosa Graaf, Coen de
    Format: application/pdf 196 p.
    Publisher: Universitat Rovira i Virgili
    Keywords: Heisenberg Hamiltonian The extended CAS DDCI CASPT2 ab initio calculations Magnetic susceptibility magnetic coupling constant
    Title: The calculation of the thermal dependency of the magnetic susceptibility in extended systems with ab initio electronic structure parameters
    Subject: 544 - Química física 54 - Química

  • Keywords:

    544 - Química física
    54 - Química

  • Documents:

    Memoria

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