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How Well Can Theory Predict Addition-Fragmentation Equilibrium Constants in RAFT Polymerization?

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dc.contributor.authorLin, Ching-Yeh
dc.contributor.authorCoote, Michelle
dc.date.accessioned2015-12-10T22:41:32Z
dc.date.issued2009
dc.date.updated2016-02-24T10:43:25Z
dc.description.abstractHigh level ab initio molecular orbital calculations are used to study the additionfragmentation equilibrium constants of S-S'-bis(methyl-2-propionate)- trithiocarbonate mediated polymerization of methyl acrylate in toluene at 30°C. The results, which sho
dc.identifier.issn0004-9425
dc.identifier.urihttp://hdl.handle.net/1885/57967
dc.publisherCSIRO Publishing
dc.sourceAustralian Journal of Chemistry
dc.subjectKeywords: Ab initio molecular orbital calculation; Addition-fragmentation; Methyl acrylates; Order of magnitude; RAft polymerization; Related systems; Trithiocarbonate; Acrylic monomers; Living polymerization; Molecular orbitals; Polymethyl methacrylates; Toluene;
dc.titleHow Well Can Theory Predict Addition-Fragmentation Equilibrium Constants in RAFT Polymerization?
dc.typeJournal article
local.bibliographicCitation.issue11
local.bibliographicCitation.lastpage1483
local.bibliographicCitation.startpage1479
local.contributor.affiliationLin, Ching-Yeh, College of Physical and Mathematical Sciences, ANU
local.contributor.affiliationCoote, Michelle, College of Physical and Mathematical Sciences, ANU
local.contributor.authoruidLin, Ching-Yeh, u4169280
local.contributor.authoruidCoote, Michelle, u4031074
local.description.embargo2037-12-31
local.description.notesImported from ARIES
local.identifier.absfor030305 - Polymerisation Mechanisms
local.identifier.absfor030799 - Theoretical and Computational Chemistry not elsewhere classified
local.identifier.absseo970103 - Expanding Knowledge in the Chemical Sciences
local.identifier.ariespublicationu4217927xPUB422
local.identifier.citationvolume62
local.identifier.doi10.1071/CH09269
local.identifier.scopusID2-s2.0-70749119553
local.identifier.thomsonID000271976400006
local.type.statusPublished Version

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