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TFermion: a non-Clifford gate cost assessment library of quantum phase estimation algorithms for quantum chemistry

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dc.contributor.authorMoreno Casares, Pablo Antonio
dc.contributor.authorCampos, Roberto
dc.contributor.authorMartín-Delgado Alcántara, Miguel Ángel
dc.date.accessioned2023-06-22T10:57:09Z
dc.date.available2023-06-22T10:57:09Z
dc.date.issued2022-07-13
dc.description© The Autors. We want to thank the very kind explanations of Emiel Koridon of some calculations in one of his articles and beyond. Similarly, we thank answers from Nicolas Rubin and Ryan Babbush on the use of OpenFermion, Joonho Lee on the code from [39], and Antonio Hidalgo, Maria Jesus Moran, Nelaine Mora and Javier Garcia on quantum chemistry. We acknowledge financial support from the Spanish MINECO grants MINECO/FEDER Projects FIS 2017-91460-EXP, PGC2018-099169-B-I00 FIS-2018, from CAM/FEDER Project No. S2018/TCS-4342 (QUITEMAD-CM), and from Spanish MCIN with funding from European Union NextGenerationEU (PRTR-C17.I1) and Ministry of Economic Affairs Quantum ENIA project. The research of M.A.M.-D. has been partially supported by the U.S. Army Research Office through Grant No. W911NF-14-1-0103. P. A. M. C. thanks the support of a MECD grant FPU17/03620, and R.C. the support of a CAM grant IND2019/TIC17146.
dc.description.abstractQuantum Phase Estimation is one of the most useful quantum computing algorithms for quantum chemistry and as such, significant effort has been devoted to designing efficient implementations. In this article, we introduce TFermion, a library designed to estimate the T-gate cost of such algorithms, for an arbitrary molecule. As examples of usage, we estimate the T-gate cost of a few simple molecules and compare the same Taylorization algorithms using Gaussian and plane-wave basis.
dc.description.departmentDepto. de Física Teórica
dc.description.facultyFac. de Ciencias Físicas
dc.description.refereedTRUE
dc.description.sponsorshipMinisterio de Economia y Competitividad (MINECO)/FEDER
dc.description.sponsorshipMinisterio de Ciencia e Innovación (MICINN)/AEI
dc.description.sponsorshipMinisterio de Economía y Competitividad (MINECO)
dc.description.sponsorshipMinisterio de Educación, Cultura y Deporte (MECD)
dc.description.sponsorshipComunidad de Madrid/FEDER
dc.description.sponsorshipComunidad de Madrid
dc.description.sponsorshipU.S. Army Research Office
dc.description.statuspub
dc.eprint.idhttps://eprints.ucm.es/id/eprint/74296
dc.identifier.doi10.22331/q-2022-07-20-768
dc.identifier.issn2521-327X
dc.identifier.officialurlhttp://dx.doi.org/10.22331/q-2022-07-20-768
dc.identifier.relatedurlhttps://quantum-journal.org/
dc.identifier.urihttps://hdl.handle.net/20.500.14352/71931
dc.journal.titleQuantum
dc.language.isoeng
dc.publisherVerein Forderung Open Access Publizierens Quantenwissenschaf
dc.relation.projectID(FIS 2017-91460-EXP; PGC2018-099169-B-I00 FIS2018)
dc.relation.projectIDPRTR-C17.I1
dc.relation.projectIDQuantum ENIA
dc.relation.projectIDFPU17/03620
dc.relation.projectIDQUITEMAD-CM (S2018/TCS-4342)
dc.relation.projectIDIND2019/TIC17146
dc.relation.projectIDW911NF-14-1-0103
dc.rightsAtribución 3.0 España
dc.rights.accessRightsopen access
dc.rights.urihttps://creativecommons.org/licenses/by/3.0/es/
dc.subject.cdu53
dc.subject.keywordMany body theories
dc.subject.keywordComputation
dc.subject.ucmFísica (Física)
dc.subject.unesco22 Física
dc.titleTFermion: a non-Clifford gate cost assessment library of quantum phase estimation algorithms for quantum chemistry
dc.typejournal article
dc.volume.number6
dspace.entity.typePublication
relation.isAuthorOfPublication8962ecbe-5f71-4c6d-8db5-fabc3ff31a99
relation.isAuthorOfPublication1cfed495-7729-410a-b898-8196add14ef6
relation.isAuthorOfPublication.latestForDiscovery8962ecbe-5f71-4c6d-8db5-fabc3ff31a99

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