On the diverse bonding situations in nanostructures : an ab initio computational study

This computational study investigates diverse bonding situations in nanostructures (carbon nanotubes, fullerenes, metal compounds) spanning a broad range of energies. Weak, dispersive interactions and covalent metal-ligand and metal-metal bonding are examined. The results of efficient density functi...

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Bibliografiska uppgifter

Huvudupphov:	Pankewitz, Tobias
Materialtyp:	Online
Språk:	engelska
Utgiven:	KIT Scientific Publishing 2021
Ämnen:	QD1-999 open-cage fullerenes single-walled carbon nanotubes subvalent aluminium and magnesium compounds computational chemistry nanostructures thema EDItEUR::P Mathematics and Science::PN Chemistry
Länkar:	34552
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