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@ARTICLE{Singer:46384,
      author       = {Singer, R. and Fähnle, M. and Bihlmayer, G.},
      title        = {{C}onstrained spin-density functional theory for excited
                      magnetic configurations in an adiabatic approximation},
      journal      = {Physical review / B},
      volume       = {71},
      number       = {21},
      issn         = {1098-0121},
      address      = {College Park, Md.},
      publisher    = {APS},
      reportid     = {PreJuSER-46384},
      pages        = {214435},
      year         = {2005},
      note         = {Record converted from VDB: 12.11.2012},
      abstract     = {The magnetic energy and the magnitudes of the magnetic
                      moments are calculated for excited magnetic configurations
                      with strong moment cantings. The calculations are performed
                      by use of an exact constraining scheme for the moments via
                      constraining fields, and by use of an approximate
                      constraining scheme via the prescription of the local spin
                      quantization axes in the spin atomic sphere approximation.
                      It is shown that the latter constraining scheme becomes
                      totally inadequate for systems with strong moment cantings.
                      When increasing the degree of moment canting, the magnitudes
                      of the moments remain rather stable for Fe but become
                      completely unstable for Ni while for Co the situation is in
                      between the two cases.},
      keywords     = {J (WoSType)},
      cin          = {IFF-TH-I},
      ddc          = {530},
      cid          = {I:(DE-Juel1)VDB30},
      pnm          = {Kondensierte Materie},
      pid          = {G:(DE-Juel1)FUEK242},
      shelfmark    = {Physics, Condensed Matter},
      typ          = {PUB:(DE-HGF)16},
      UT           = {WOS:000230276600072},
      doi          = {10.1103/PhysRevB.71.214435},
      url          = {https://juser.fz-juelich.de/record/46384},
}