title: Cubic-scaling algorithm and self-consistent field for the random-phase approximation with second-order screened exchange.
abstract: The random-phase approximation with second-order screened exchange (RPA+SOSEX) is a model of electron correlation energy with two caveats: its accuracy depends on an arbitrary choice of mean field, and it scales as O(n(5)) operations and O(n(3)) memory for n electrons. We derive a new algorithm that reduces its scaling to O(n(3)) operations and O(n(2)) memory using controlled approximations and a new self-consistent field that approximates Brueckner coupled-cluster doubles theory with RPA+SOSEX, referred to as Brueckner RPA theory. The algorithm comparably reduces the scaling of second-order Mo̸ller-Plesset perturbation theory with smaller cost prefactors than RPA+SOSEX. Within a semiempirical model, we study H2 dissociation to test accuracy and Hn rings to verify scaling.
authors.affiliation: Sandia National Laboratories, Albuquerque, New Mexico 87185, USA.
authors.forename: Jonathan E
authors.initials: JE
authors.lastname: Moussa