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arxiv: 0707.3850 · v2 · submitted 2007-07-26 · ❄️ cond-mat.mtrl-sci · cond-mat.other

Spin wave dispersion based on the quasiparticle self-consistent GW method: NiO, MnO and α-MnAs

classification ❄️ cond-mat.mtrl-sci cond-mat.other
keywords alphamnasqsgwquasiparticlemethodself-consistentspinwave
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We present spin wave dispersions in MnO, NiO, and $\alpha$-MnAs based on the quasiparticle self-consistent $GW$ method (\qsgw), which determines an optimum quasiparticle picture. For MnO and NiO, \qsgw results are in rather good agreement with experiments, in contrast to the LDA and LDA+U description. For $\alpha$-MnAs, we find a collinear ferromagnetic ground state in \qsgw, while this phase is unstable in the LDA.

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