Publication:

Simplistic correlations between molecular electronic properties and inhibition efficiencies: Do they really exist?

Date

2021
Journal article
https://doi.org/10.1016/j.corsci.2020.108856
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dc.contributor.authorKokalj, Anton
dc.contributor.authorLozinsek, Matic
dc.contributor.authorKapun, Barbara
dc.contributor.authorTaheri, Peyman
dc.contributor.authorNeupane, Shova
dc.contributor.authorLosada-Perez, Patricia
dc.contributor.authorXie, Chenyang
dc.contributor.authorStavber, Stojan
dc.contributor.authorCrespo, Daniel
dc.contributor.authorRenner, Frank
dc.contributor.authorMol, Arjan
dc.contributor.authorMilosev, Ingrid
dc.contributor.imecauthorRenner, Frank
dc.contributor.orcidextLozinsek, Matic::0000-0002-1864-4248
dc.contributor.orcidextTaheri, Peyman::0000-0002-3051-7292
dc.contributor.orcidextNeupane, Shova::0000-0002-3692-5123
dc.contributor.orcidextLosada-Perez, Patricia::0000-0003-1905-516X
dc.contributor.orcidextCrespo, Daniel::0000-0003-1743-2400
dc.contributor.orcidextMol, Arjan::0000-0003-1810-5145
dc.date.accessioned2022-02-21T14:29:45Z
dc.date.available2022-02-21T14:29:45Z
dc.date.issued2021
dc.identifier.doi10.1016/j.corsci.2020.108856
dc.identifier.issn0010-938X
dc.identifier.urihttps://imec-publications.be/handle/20.500.12860/38958
dc.publisherPERGAMON-ELSEVIER SCIENCE LTD
dc.source.beginpage108856
dc.source.issuena
dc.source.journalCORROSION SCIENCE
dc.source.numberofpages12
dc.source.volume179
dc.subject.keywordsDENSITY-FUNCTIONAL THEORY
dc.subject.keywordsCORROSION-INHIBITORS
dc.subject.keywordsHIGH-THROUGHPUT
dc.subject.keywordsCARBON-STEEL
dc.subject.keywordsDFT
dc.subject.keywordsELECTRONEGATIVITY
dc.subject.keywordsDISSOCIATION
dc.subject.keywordsADSORPTION
dc.subject.keywordsPREDICT
dc.title

Simplistic correlations between molecular electronic properties and inhibition efficiencies: Do they really exist?

dc.typeJournal article
dspace.entity.typePublication
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