Chuck-Hou Yee edited cuprates2b.tex  over 7 years ago

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anions less electronegative than Cu, as these anions would capture dopants  intended for the superconducting plane, producing additional Fermi surfaces.  \emph{Global stability} -- In order to perform  Outcome : proposed compound with more confidence. 

Accuracy of LDA. Metastable structures do exist. One cuprates are above the hull.  \emph{Electronic structure} -- In order to evaluate the prospects of superconductivity, we computed the orbitally-resolved density of states (Fig.~\ref{fig:hcsco-bands}). There is indeed a single band crossing the Fermi level Hg(CaS)$_2$CuO$_2$