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Stability calculations for Eu@C74 isomers

✍ Scribed by Filip Uhlík; Zdeněk Slanina; Shyi-Long Lee; Ludwik Adamowicz; Shigeru Nagase

Book ID
112185654
Publisher
John Wiley and Sons
Year
2012
Tongue
English
Weight
144 KB
Volume
113
Category
Article
ISSN
0020-7608

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Relative Stabilities of C74 Isomers
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Mg@C74isomers: Calculated relative conce
Mg@C74isomers: Calculated relative concentrations and comparison with Ca@C74
✍ Uhlík, Filip ;Slanina, Zdeněk ;Nagase, Shigeru 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 477 KB

## Abstract Computations for two C~74~‐based endohedrals, Mg@C~74~ and Ca@C~74~, are presented. A set of four different C~74~ cages is considered, namely one isomer with isolated pentagons and three with pentagon–pentagon junctions. However, the endohedral based on the cage with isolated pentagons