diff --git a/Manuscript/seniority.bib b/Manuscript/seniority.bib index 0512343..138e291 100644 --- a/Manuscript/seniority.bib +++ b/Manuscript/seniority.bib @@ -832,3 +832,38 @@ volume = {14}, year = {2018}, bdsk-url-1 = {https://doi.org/10.1021/acs.jctc.8b00406}} + +@article{Kossoski_2021, +author = {Kossoski, Fábris and Marie, Antoine and Scemama, Anthony and Caffarel, Michel and Loos, Pierre-François}, +title = {Excited States from State-Specific Orbital-Optimized Pair Coupled Cluster}, +journal = {J. Chem. Theory Comput.}, +volume = {17}, +number = {8}, +pages = {4756-4768}, +year = {2021}, +doi = {10.1021/acs.jctc.1c00348}, +URL = { + https://doi.org/10.1021/acs.jctc.1c00348 +}, +eprint = { + https://doi.org/10.1021/acs.jctc.1c00348 +} +} + +@article{Marie_2021, +author = {Marie,Antoine and Kossoski,Fábris and Loos,Pierre-François }, +title = {Variational coupled cluster for ground and excited states}, +journal = {J. Chem. Phys.}, +volume = {155}, +number = {10}, +pages = {104105}, +year = {2021}, +doi = {10.1063/5.0060698}, +URL = { + https://doi.org/10.1063/5.0060698 +}, +eprint = { + https://doi.org/10.1063/5.0060698 +} +} + diff --git a/Manuscript/seniority.tex b/Manuscript/seniority.tex index 1ab0692..381e059 100644 --- a/Manuscript/seniority.tex +++ b/Manuscript/seniority.tex @@ -102,8 +102,8 @@ while higher sectors tend to contribute progressively less. \cite{Bytautas_2011, In addition, sCI0 is size-consistent, a property that is not shared by higher orders of seniority-based CI. However, already at the sCI0 level, $\Ndet$ scales exponentially with $\Nbas$, since excitations of all degrees are included. Therefore, despite the encouraging successes of seniority-based CI methods, their unfavorable computational scaling restricts applications to very small systems. \cite{Shepherd_2016} -Besides CI, other methods that exploit the concept of seniority number have been pursued. \cite{Limacher_2013,Limacher_2014,Tecmer_2014,Boguslawski_2014a,Boguslawski_2015,Boguslawski_2014b,Boguslawski_2014c,Johnson_2017,Fecteau_2020,Johnson_2020,Johnson_2022,Fecteau_2022,Henderson_2014,Stein_2014,Henderson_2015,Chen_2015,Bytautas_2018} -\textcolor{red}{In particular, coupled cluster restricted to paired double excitations, \cite{Henderson_2014,Stein_2014,Henderson_2015} which is the same as the antisymmetric product of 1-reference orbital geminals, +Besides CI, other methods that exploit the concept of seniority number have been pursued. \cite{Limacher_2013,Limacher_2014,Tecmer_2014,Boguslawski_2014a,Boguslawski_2015,Boguslawski_2014b,Boguslawski_2014c,Johnson_2017,Fecteau_2020,Johnson_2020,Johnson_2022,Fecteau_2022,Henderson_2014,Stein_2014,Henderson_2015,Kossoski_2021,Marie_2021,Chen_2015,Bytautas_2018} +\textcolor{red}{In particular, coupled cluster restricted to paired double excitations, \cite{Henderson_2014,Stein_2014,Henderson_2015,Kossoski_2021,Marie_2021} which is the same as the antisymmetric product of 1-reference orbital geminals, \cite{Limacher_2013,Limacher_2014,Tecmer_2014,Boguslawski_2014a,Boguslawski_2015,Boguslawski_2014b,Boguslawski_2014c,Johnson_2017,Fecteau_2020,Johnson_2020,Johnson_2022,Fecteau_2022} provides very similar energies as DOCI, and at a very favourable polynomial cost.}