Research Data Supporting "Theory and Implementation of a Novel Stochastic Approach to Coupled Cluster"
Charles J. C. Scott, Roberto Di Remigio, T. Daniel Crawford, Alex J. W. Thom · Zenodo (CERN European Organization for Nuclear Research) · 2020
Research data supporting "Theory and Implementation of a Novel Stochastic Approach to Coupled Cluster". This dataset includes all outputs for diagrammatic Coupled Cluster Monte Carlo simulations on systems of noninteracting hydrogen square replicas, and the double dissociation of water. This dataset also includes all code used to generate, analyse and plot all diagCCMC results.