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dc.contributor.authorNeufeld, Verenaen
dc.contributor.authorSpencer, James Sen
dc.contributor.authorBlunt, Nick Sen
dc.contributor.authorChoi, Seonghoonen
dc.contributor.authorEtrych, Jirien
dc.contributor.authorFilip, Maria-Andreeaen
dc.contributor.authorFoulkes, WMCen
dc.contributor.authorFranklin, Ruthen
dc.contributor.authorHandley, Willen
dc.contributor.authorMalone, Fionn Den
dc.contributor.authorDi Remigio, Robertoen
dc.contributor.authorRogers, TWen
dc.contributor.authorScott, Charlesen
dc.contributor.authorShepherd, James Jen
dc.contributor.authorVigor, WAen
dc.contributor.authorWeston, Jen
dc.contributor.authorXu, RuQingen
dc.contributor.authorThom, Alexen
dc.date.accessioned2019-04-10T12:06:23Z
dc.date.available2019-04-10T12:06:23Z
dc.identifier.urihttps://www.repository.cam.ac.uk/handle/1810/291403
dc.descriptionThis contains the input and output files used to generate the data in the figures and tables in the associated publication. Most files are in text-format, with some ionen
dc.formatHANDE-QMC ( http://www.hande.org.uk/ and https://github.com/hande-qmc/hande ) PSI4 ( http://www.psicode.org/ and https://github.com/psi4/psi4 )en
dc.rightsAttribution 4.0 Internationalen
dc.rightsAttribution 4.0 Internationalen
dc.rightsAttribution 4.0 Internationalen
dc.rightsAttribution 4.0 Internationalen
dc.rightsAttribution 4.0 Internationalen
dc.rightsAttribution 4.0 Internationalen
dc.rightsAttribution 4.0 Internationalen
dc.rightsAttribution 4.0 Internationalen
dc.rightsAttribution 4.0 Internationalen
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/en
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/en
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/en
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/en
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/en
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/en
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/en
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/en
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/en
dc.subjectElectronic Structureen
dc.subjectQuantum Monte Carloen
dc.subjectOpen Source Softwareen
dc.subjectCoupled Clusteren
dc.subjectFull Configuration Interactionen
dc.subjectUniform Electron Gasen
dc.titleResearch Data and Further Information supporting "The HANDE-QMC project: open-source stochastic quantum chemistry from the ground state up"en
dc.typeDataset
dc.identifier.doi10.17863/CAM.31933
rioxxterms.licenseref.urihttp://creativecommons.org/licenses/by/4.0/en
datacite.contributor.supervisorThom, Alex JW
dcterms.formatMost files are in text-format, with some stored in HDF5 format.en
dc.contributor.orcidNeufeld, Verena [0000-0002-4204-746X]
dc.contributor.orcidHandley, Will [0000-0002-5866-0445]
dc.contributor.orcidScott, Charles [0000-0001-9277-8327]
rioxxterms.typeOtheren
pubs.funder-project-idEPSRC (1502865)
datacite.issupplementto.doi10.1021/acs.jctc.8b01217en
datacite.issupplementto.urlhttps://www.repository.cam.ac.uk/handle/1810/289204


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Attribution 4.0 International
Except where otherwise noted, this item's licence is described as Attribution 4.0 International