156 citations · 501 across the 18 of their papers we have counts for
3 papers · 1 filter
Towards near-exact solutions of molecular electronic structure: Full coupled-cluster reduction with a second-order perturbative correction
Enhua Xu, Motoyuki Uejima, Seiichiro L. Ten-no
We introduce a new augmented adaptation of the recently developed full coupled-cluster reduction (FCCR) with a second-order perturbative correction, abbreviated as FCCR(2). FCCR is…
The Ground State Electronic Energy of Benzene
Janus J. Eriksen, Tyler A. Anderson, J. Emiliano Deustua +21
We report on the findings of a blind challenge devoted to determining the frozen-core, full configuration interaction (FCI) ground state energy of the benzene molecule in a standar…
Spin-projection for quantum computation: A low-depth approach to strong correlation
Takashi Tsuchimochi, Yuto Mori, Seiichiro L. Ten-no
Although spin is a core property in fermionic systems, its symmetry can be easily violated in a variational simulation, especially when strong correlation plays a vital role therei…