Search Results for author: Daniel Kats

Found 1 papers, 0 papers with code

Towards efficient and accurate \emph{ab initio} solutions to periodic systems via transcorrelation and coupled cluster theory

no code implementations4 Mar 2021 Ke Liao, Thomas Schraivogel, Hongjun Luo, Daniel Kats, Ali Alavi

We propose a streamlined combination scheme of the transcorrelation (TC) and coupled cluster (CC) theory, which not only increases the convergence rate with respect to the basis set, but also extends the applicability of the lowest order CC approximations to strongly correlated regimes in the three dimensional uniform electron gas (3D UEG).

Strongly Correlated Electrons Chemical Physics Computational Physics

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