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Spontaneous mirror symmetry breaking: an entropy production survey of the racemate instability and the emergence of stable scalemic stationary states.

dc.contributor.authorRibo, J. M.
dc.contributor.authorHochberg, D.
dc.contributor.funderAgencia Estatal de Investigación (AEI)
dc.contributor.orcidRibó, J. M. [0000-0001-6258-1726]
dc.contributor.orcidHochberg, D. [0000-0002-0411-019X]
dc.contributor.otherUnidad de Excelencia Científica María de Maeztu Centro de Astrobiología del Instituto Nacional de Técnica Aeroespacial y CSIC, MDM-2017-0737
dc.date.accessioned2021-04-12T08:34:14Z
dc.date.available2021-04-12T08:34:14Z
dc.date.issued2020-06-08
dc.descriptionThis article is part of the themed collection: 2020 PCCP HOT Articleses
dc.description.abstractWe study the emergence of both stable and unstable non-equilibrium stationary states (NESS), as well as spontaneous mirror symmetry breaking (SMSB) provoked by the destabilization of the racemic thermodynamic branch, for an enantioselective autocatalytic reaction network in an open flow system, and for a continuous rangenof autocatalytic orders. The system possesses a range of double bi-stability and also tri-stability depending on the autocatalytic order. We carry out entropy production and entropy flow calculations, from simulations of ordinary differential equations, stoichiometric network analysis (SNA), and consider a stability analysis of the NESS. The simulations provide a correct description of the relationship between energy state functions, the isothermal dissipated heat, entropy production and entropy flow exchange with the surroundings, and the correct solution of the balance of the entropy currents at the NESS. The validity of the General Evolution Criterion (GEC) is in full agreement with all the dynamic simulations.es
dc.description.peerreviewedPeer reviewes
dc.description.sponsorshipThe authors acknowledge the coordinated research grants CTQ2017-87864-C2-1(2)-P(MINECO) ; With funding from the Spanish government through the "María de Maeztu Unit of Excellence" accreditation (MDM-2017-0737).es
dc.identifier.citationPhysical Chemistry Chemical Physics 22(25): 14013-14025(2020)es
dc.identifier.doi10.1039/D0CP02280B
dc.identifier.e-issn1463-9084
dc.identifier.issn1463-9076
dc.identifier.otherhttps://pubs.rsc.org/en/content/articlelanding/2020/CP/D0CP02280B
dc.identifier.urihttp://hdl.handle.net/20.500.12666/220
dc.language.isoenges
dc.publisherRoyal Society of Chemistryes
dc.relationEMERGENCIA, AMPLIFICACION Y TRANSFERENCIA DE QUIRALIDAD MEDIANTE RUPTURA ESPONTANEA DE LA SIMETRIA ESPECULAR
dc.relationEMERGENCIA, AMPLIFICACION Y TRANSFERENCIA DE QUIRALIDAD MEDIANTE RUPTURA ESPONTANEA DE LA SIMETRIA ESPECULAR
dc.rights.accessRightsinfo:eu-repo/semantics/restrictedAccess
dc.rights.licenseRoyal Society of Chemistry
dc.subjectMirror symmetry brakinges
dc.subjectEntropyes
dc.subjectRacemate Instabilityes
dc.subjectReaction modelses
dc.titleSpontaneous mirror symmetry breaking: an entropy production survey of the racemate instability and the emergence of stable scalemic stationary states.es
dc.typeinfo:eu-repo/semantics/articlees
dc.type.coarhttp://purl.org/coar/resource_type/c_6501
dc.type.hasVersioninfo:eu-repo/semantics/publishedVersion
dspace.entity.typePublication
oaire.awardNumberCTQ2017-87864-C2-1-P
oaire.awardNumberCTQ2017-87864-C2-2-P
oaire.awardTitleEMERGENCIA, AMPLIFICACION Y TRANSFERENCIA DE QUIRALIDAD MEDIANTE RUPTURA ESPONTANEA DE LA SIMETRIA ESPECULAR
oaire.awardTitleEMERGENCIA, AMPLIFICACION Y TRANSFERENCIA DE QUIRALIDAD MEDIANTE RUPTURA ESPONTANEA DE LA SIMETRIA ESPECULAR
oaire.awardURIhttps://inta.metricsalad.com/handle/123456789/1195
oaire.awardURIhttps://inta.metricsalad.com/handle/123456789/1220
relation.isProjectOfPublicationb86fbb67-adce-47d7-b5ec-dd12e2e72a8e
relation.isProjectOfPublication5fc52b35-f156-4f41-8af6-72ef89dc46e4
relation.isProjectOfPublication.latestForDiscoveryb86fbb67-adce-47d7-b5ec-dd12e2e72a8e

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