Research data supporting "Multireference Stochastic Coupled Cluster"
Repository URI
Repository DOI
Change log
Authors
Scott, Charles JC
Description
Calculation integral files, outputs and restart files used within the publication of Multireference Stochastic Coupled Cluster.
Version
Software / Usage instructions
All calculations performed using the development version of HANDE QMC (homepage: http://www.hande.org.uk/). This will be reproducible using the publically available version of the HANDE QMC code after the next update (public github version: https://github.com/hande-qmc/hande)
Keywords
Quantum Monte Carlo, Electronic Structure Theory, Coupled Cluster Monte Carlo
Publisher
Sponsorship
Royal Society (UF160398)
Cambridge Trust
Corpus Christi College, Cambridge
Magdalene College, Cambridge
The Sims Fund