Research data supporting "Reducing unitary coupled cluster circuit depth by classical stochastic amplitude prescreening"

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dc.contributor.authorFilip, Maria-Andreea
dc.contributor.authorFitzpatrick, Nathan
dc.contributor.authorMuñoz Ramo, David
dc.contributor.authorThom, Alex
dc.date.accessioned2022-07-04T09:16:22Z
dc.date.available2022-07-04T09:16:22Z
dc.identifier.urihttps://www.repository.cam.ac.uk/handle/1810/338732
dc.descriptionData used to construct figures and tables in "Reducing unitary coupled cluster circuit depth by classical stochastic amplitude prescreening". The HANDE folder contains HANDE output files (.out) and necessary integral files (FCIDUMP). The screening_results folder contains amplitude files (.dat) resulting from the HANDE calculations and then used for VQE screening. All other folders contain screened VQE results corresponding to the system in the folder name (.csv) and the python scripts needed to generate figures from them (.py).
dc.description.sponsorshipMicrosoft for Startups The Cambridge Trust Corpus Christi College
dc.formatQMC results were generated using a development version of HANDE-QMC (http://www.hande.org.uk/), while VQE results were obtained with the EUMEN software. Python scripts can be run using Python 3 with the numpy and matplotlib libraries installed.
dc.rightsAttribution 4.0 International (CC BY 4.0)
dc.rights.urihttps://creativecommons.org/licenses/by/4.0/
dc.subjectQuantum Computing
dc.subjectQuantum Monte Carlo
dc.subjectUnitary Coupled Cluster
dc.subjectVariational Quantum Eigensolver
dc.titleResearch data supporting "Reducing unitary coupled cluster circuit depth by classical stochastic amplitude prescreening"
dc.typeDataset
dc.publisher.departmentYusuf Hamied Department of Chemistry
dc.date.updated2022-07-01T08:36:26Z
dc.identifier.doi10.17863/CAM.86061
rioxxterms.licenseref.urihttps://creativecommons.org/licenses/by/4.0/
datacite.contributor.supervisorThom, Alex JW
dcterms.format.dat .csv .py .out (All text files.)
dc.contributor.orcidFilip, Maria-Andreea [0000-0002-9551-0235]
dc.contributor.orcidThom, Alexander [0000-0002-2417-7869]
rioxxterms.typeOther
pubs.funder-project-idRoyal Society (UF160398)
datacite.issupplementto.doi10.1103/PhysRevResearch.4.023243
datacite.issupplementto.urlhttps://www.repository.cam.ac.uk/handle/1810/338827
cam.depositDate2022-07-01
pubs.licence-identifierapollo-deposit-licence-2-1
pubs.licence-display-nameApollo Repository Deposit Licence Agreement


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