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Title of Journal: Russ Chem Bull

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Abbravation: Russian Chemical Bulletin

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Springer US

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DOI

10.1016/0160-7383(88)90058-8

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1573-9171

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Carbon and silicon triangulenes searching for mol

Authors: O A Gapurenko A G Starikov R M Minyaev V I Minkin
Publish Date: 2012/05/29
Volume: 60, Issue: 8, Pages: 1517-1524
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Abstract

The structures of a number of neutral highspin triangular carbon and silicon systems were studied and their stabilities were predicted using the density functional theory methods B3LYP functional with the 6311++G and 6311+G basis sets The calculated spinspin coupling constants have high positive values thus indicating strong ferromagnetic interactions in the title systems

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