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The Journal of Chemical Physics|December 29, 2010
Benchmark studies of variational, unitary and extended coupled cluster methodsBridgette Cooper, Peter J KnowlesJournal of the American Chemical Society|April 20, 2013
The cinchona primary amine-catalyzed asymmetric epoxidation and hydroperoxidation of α,β-unsaturated carbonyl compounds with hydrogen peroxideOlga Lifchits, Manuel Mahlau, Corinna M Reisinger, et al.Journal of the Royal Society, Interface|September 11, 2008
Analysis of polarization in QM/MM modelling of biologically relevant hydrogen bondsKittusamy Senthilkumar, Jon I Mujika, Kara E Ranaghan, et al.The Journal of Chemical Physics|March 1, 2013
Rigorously extensive orbital-invariant renormalized perturbative triples corrections from quasi-variational coupled cluster theoryJames B Robinson, Peter J KnowlesJournal of Chemical Theory and Computation|November 24, 2015
Benchmark Quasi-Variational Coupled Cluster Calculations of Multiple Bond BreakingJames B Robinson, Peter J KnowlesThe Journal of Chemical Physics|October 12, 2018
Quasi-variational coupled-cluster theory: Performance of perturbative treatments of connected triple excitationsJoshua A Black, Peter J KnowlesPhysical Chemistry Chemical Physics : PCCP|April 14, 2012
Breaking multiple covalent bonds with Hartree-Fock-based quantum chemistry: Quasi-Variational Coupled Cluster theory with perturbative treatment of triple excitationsJames B Robinson, Peter J KnowlesThe Journal of Chemical Physics|August 3, 2011
Approximate variational coupled cluster theoryJames B Robinson, Peter J KnowlesThe Journal of Chemical Physics|February 11, 2012
Quasi-variational coupled cluster theoryJames B Robinson, Peter J KnowlesThe Journal of Chemical Physics|August 17, 2012
Application of the quasi-variational coupled cluster method to the nonlinear optical properties of model hydrogen systemsJames B Robinson, Peter J KnowlesPageof 12