Matches in SemOpenAlex for { <https://semopenalex.org/work/W3098536124> ?p ?o ?g. }
- W3098536124 abstract "The $Delta text{NO}$ method for static correlation is combined with second-order M{o}ller-Plesset perturbation theory (MP2) and coupled-cluster singles and doubles (CCSD) to account for dynamic correlation. The MP2 and CCSD expressions are adapted from finite-temperature CCSD, which includes orbital occupancies and vacancies, and expanded orbital summations. Correlation is partitioned with the aid of damping factors incorporated into the MP2 and CCSD residual equations. Potential energy curves for a selection of diatomics are in good agreement with extrapolated full configuration interaction results (exFCI), and on par with conventional multireference approaches." @default.
- W3098536124 created "2020-11-23" @default.
- W3098536124 creator A5013626426 @default.
- W3098536124 creator A5039205389 @default.
- W3098536124 date "2020-01-02" @default.
- W3098536124 modified "2023-10-03" @default.
- W3098536124 title "Capturing static and dynamic correlation with ΔNO-MP2 and ΔNO-CCSD" @default.
- W3098536124 cites W1447552204 @default.
- W3098536124 cites W1532595750 @default.
- W3098536124 cites W1536545035 @default.
- W3098536124 cites W1708984004 @default.
- W3098536124 cites W1887172372 @default.
- W3098536124 cites W1964577547 @default.
- W3098536124 cites W1966734529 @default.
- W3098536124 cites W1968757798 @default.
- W3098536124 cites W1970000657 @default.
- W3098536124 cites W1970926733 @default.
- W3098536124 cites W1973514609 @default.
- W3098536124 cites W1973872176 @default.
- W3098536124 cites W1976059606 @default.
- W3098536124 cites W1991560440 @default.
- W3098536124 cites W1992387414 @default.
- W3098536124 cites W1997641598 @default.
- W3098536124 cites W1999639915 @default.
- W3098536124 cites W2002019292 @default.
- W3098536124 cites W2004095105 @default.
- W3098536124 cites W2005436056 @default.
- W3098536124 cites W2009762547 @default.
- W3098536124 cites W2010120873 @default.
- W3098536124 cites W2010519609 @default.
- W3098536124 cites W2012039665 @default.
- W3098536124 cites W2012507958 @default.
- W3098536124 cites W2012778107 @default.
- W3098536124 cites W2018541907 @default.
- W3098536124 cites W2020156296 @default.
- W3098536124 cites W2025793583 @default.
- W3098536124 cites W2026858719 @default.
- W3098536124 cites W2028452047 @default.
- W3098536124 cites W2029430790 @default.
- W3098536124 cites W2029539483 @default.
- W3098536124 cites W2033134911 @default.
- W3098536124 cites W2033608089 @default.
- W3098536124 cites W2033875786 @default.
- W3098536124 cites W2036942028 @default.
- W3098536124 cites W2039305094 @default.
- W3098536124 cites W2040466218 @default.
- W3098536124 cites W2040770475 @default.
- W3098536124 cites W2052766668 @default.
- W3098536124 cites W2054916854 @default.
- W3098536124 cites W2064584618 @default.
- W3098536124 cites W2069006374 @default.
- W3098536124 cites W2069495508 @default.
- W3098536124 cites W2069605277 @default.
- W3098536124 cites W2074966264 @default.
- W3098536124 cites W2077739389 @default.
- W3098536124 cites W2079355107 @default.
- W3098536124 cites W2082089040 @default.
- W3098536124 cites W2084542938 @default.
- W3098536124 cites W2093122331 @default.
- W3098536124 cites W2151220474 @default.
- W3098536124 cites W2168830046 @default.
- W3098536124 cites W2244041926 @default.
- W3098536124 cites W2312245085 @default.
- W3098536124 cites W2323175157 @default.
- W3098536124 cites W2325131227 @default.
- W3098536124 cites W2327492584 @default.
- W3098536124 cites W2329118757 @default.
- W3098536124 cites W2481903102 @default.
- W3098536124 cites W2484276062 @default.
- W3098536124 cites W2510588285 @default.
- W3098536124 cites W2583456228 @default.
- W3098536124 cites W2749308944 @default.
- W3098536124 cites W2788359998 @default.
- W3098536124 cites W2789917949 @default.
- W3098536124 cites W2807998816 @default.
- W3098536124 cites W2810217004 @default.
- W3098536124 cites W2883364041 @default.
- W3098536124 cites W2883971929 @default.
- W3098536124 cites W2884025209 @default.
- W3098536124 cites W2887441247 @default.
- W3098536124 cites W2897033016 @default.
- W3098536124 cites W2915920394 @default.
- W3098536124 cites W2949625893 @default.
- W3098536124 cites W2966228469 @default.
- W3098536124 cites W3098878417 @default.
- W3098536124 cites W3104357743 @default.
- W3098536124 cites W3104541857 @default.
- W3098536124 cites W3105696068 @default.
- W3098536124 cites W3106327456 @default.
- W3098536124 cites W4232414218 @default.
- W3098536124 doi "https://doi.org/10.1063/1.5140669" @default.
- W3098536124 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/31914756" @default.
- W3098536124 hasPublicationYear "2020" @default.
- W3098536124 type Work @default.
- W3098536124 sameAs 3098536124 @default.
- W3098536124 citedByCount "12" @default.
- W3098536124 countsByYear W30985361242020 @default.
- W3098536124 countsByYear W30985361242021 @default.
- W3098536124 countsByYear W30985361242022 @default.
- W3098536124 crossrefType "journal-article" @default.