640 research outputs found
Comment on "Direct evidence for hidden one-dimensional Fermi surface of hexagonal K0.25WO3"
We comment a recent work titled "Direct evidence for hidden one-dimensional
Fermi surface of hexagonal K0.25WO3". In this paper the authors report
photoemission and theoretical results on the K0.25WO3 system which led them to
propose that a Charge Density Wave (CDW), associated with hidden
one-dimensional bands, was responsible for the well known resistivity anomaly
in such system.
In the present comment we report the results of a first principles density
functional theory (DFT) study showing that there are no one-dimensional bands
as suggested by these authors
Magnetism and Charge ordering in TMTTF-PF organic crystals
Using a combination of Density Functional Theory, mean-field analysis and
exact diagonalization calculations we reveal the emergence of a dimerized
charge ordered state in TMTTF-PF organic crystal. The interplay between
charge and spin order leads to a rich phase diagram. Coexistence of charge
ordering with a structural dimerization results in a ferroelectric phase, which
has been observed experimentally. The tendency to the dimerization is
magnetically driven revealing TMTTF-PF as a multiferroic material
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