207 citations · 307 across the 9 of their papers we have counts for
Showing 2024Show all
2 papers · 1 filter
physics.chem-ph2024
Tensor Decomposed Distinguishable Cluster. I. Triples Decomposition
Charlotte Rickert, Denis Usvyat, Daniel Kats
We present a cost-reduced approach for the distinguishable cluster approximation to coupled cluster with singles, doubles and iterative triples (DC-CCSDT) based on a tensor decompo…
physics.chem-ph2024★ 4 cited
Aperiodic defects in periodic solids
Robert H. Lavroff, Daniel Kats, Lorenzo Maschio +4
To date, computational methods for modeling defects (vacancies, adsorbates, etc.) rely on periodic supercells in which the defect is far enough from its repeated image such that th…