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


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Type
Dataset
Change log
Authors
Filip, Maria-Andreea  ORCID logo  https://orcid.org/0000-0002-9551-0235
Fitzpatrick, Nathan 
Muñoz Ramo, David 
Description

Data 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).

Version
Software / Usage instructions
QMC 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.
Keywords
Quantum Computing, Quantum Monte Carlo, Unitary Coupled Cluster, Variational Quantum Eigensolver
Publisher
Sponsorship
Royal Society (UF160398)
Microsoft for Startups The Cambridge Trust Corpus Christi College
Relationships
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