Pericyclic reaction benchmarks: hierarchical computations targeting CCSDT(Q)/CBS and analysis of DFT performance

scientific article published in 2022

Pericyclic reaction benchmarks: hierarchical computations targeting CCSDT(Q)/CBS and analysis of DFT performance is …
instance of (P31):
scholarly articleQ13442814

External links are
P356DOI10.1039/D2CP02234F

P50authorHenry F. SchaeferQ3123377
Friedrich Matthias BickelhauptQ56432748
Trevor A HamlinQ59824391
Marco Dalla TiezzaQ64046718
Pascal VermeerenQ89507225
Mitchell E LahmQ90970520
Mark E WolfQ90975988
Wesley D AllenQ92363998
P275copyright licenseCreative Commons Attribution 3.0 UnportedQ14947546
P6216copyright statuscopyrightedQ50423863
P433issue30
P921main subjectcomputational benchmarkQ125963897
P1104number of pages15
P304page(s)18028-18042
P577publication date2022-01-01
P1433published inPhysical Chemistry Chemical PhysicsQ3018671
P1476titlePericyclic reaction benchmarks: hierarchical computations targeting CCSDT(Q)/CBS and analysis of DFT performance
P478volume24

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