t2 comment on goodson
This commit is contained in:
parent
4c78b6418a
commit
2fbf444780
@ -1614,6 +1614,8 @@ Their method consists in refining self-consistently the values of $E(\lambda)$ c
|
||||
When the values of $E(\lambda)$ on the so-called contour are converged, Cauchy's integrals formula \eqref{eq:Cauchy} is invoked to compute the values at $E(\lambda=1)$ which corresponds to the final estimate of the FCI energy.
|
||||
The authors illustrate this protocol on the dissociation curve of \ce{LiH} and the stretched water molecule showing encouraging results. \cite{Mihalka_2019}
|
||||
|
||||
\titou{T2 will add a comment about Goodson's remark on the failure of low-order approximants when $\alpha$ and $\beta$ singularities are present.}
|
||||
|
||||
%%%%%%%%%%%%%%%%%%%%
|
||||
\section{Conclusion}
|
||||
%%%%%%%%%%%%%%%%%%%%
|
||||
|
Loading…
Reference in New Issue
Block a user