Comprehensive theoretical study of all 1812 C60 isomers

scientific article published on 24 May 2017

Comprehensive theoretical study of all 1812 C60 isomers is …
instance of (P31):
scholarly articleQ13442814

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P356DOI10.1039/C7CP00735C
P698PubMed publication ID28537281

P50authorPeter SchwerdtfegerQ7176827
P2093author name stringAndreas Hansen
Rebecca Sure
Stefan Grimme
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Competition between Even and Odd Fullerenes: C118, C119, and C120Q58279269
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P433issue22
P407language of work or nameEnglishQ1860
P304page(s)14296-14305
P577publication date2017-05-24
P1433published inPhysical Chemistry Chemical PhysicsQ3018671
P1476titleComprehensive theoretical study of all 1812 C60 isomers
P478volume19

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cites work (P2860)
Q47565726A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactions
Q46313384Automated and efficient quantum chemical determination and energetic ranking of molecular protonation sites
Q92933832Toward Understanding the Isomeric Stability of Fullerenes with Density Functional Theory and the Information-Theoretic Approach

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