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Chuck-Hou Yee edited cuprates2b.tex
over 7 years ago
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\emph{Global stability} --
\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$_2$
Outcome : proposed compound with more confidence.
Jury is out.
Discuss the notion of 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$_2$