About: Relative Production Yields in Homologous Metallofullerene Series: Computations for X@C-74 and Z@C-82 Endohedrals     Goto   Sponge   NotDistinct   Permalink

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Description
  • The paper reports computations for Mg@C-74, Ca@C-74, Sr@C-74 and Ba@C-74 based on encapsulation into the IPR (isolated pentagon rule) C-74 cage, and for Al@C-82, Sc@C-82, Y@C-82 and La@C-82 with encapsulation into the C-2v IPR C-82 cage. Their production yields are estimated using the encapsulation Gibbs-energy terms and saturated metal pressures. The results can be related to the ionization potentials of the free metal atoms.
  • The paper reports computations for Mg@C-74, Ca@C-74, Sr@C-74 and Ba@C-74 based on encapsulation into the IPR (isolated pentagon rule) C-74 cage, and for Al@C-82, Sc@C-82, Y@C-82 and La@C-82 with encapsulation into the C-2v IPR C-82 cage. Their production yields are estimated using the encapsulation Gibbs-energy terms and saturated metal pressures. The results can be related to the ionization potentials of the free metal atoms. (en)
Title
  • Relative Production Yields in Homologous Metallofullerene Series: Computations for X@C-74 and Z@C-82 Endohedrals
  • Relative Production Yields in Homologous Metallofullerene Series: Computations for X@C-74 and Z@C-82 Endohedrals (en)
skos:prefLabel
  • Relative Production Yields in Homologous Metallofullerene Series: Computations for X@C-74 and Z@C-82 Endohedrals
  • Relative Production Yields in Homologous Metallofullerene Series: Computations for X@C-74 and Z@C-82 Endohedrals (en)
skos:notation
  • RIV/00216208:11310/12:10191806!RIV14-MSM-11310___
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  • 164876
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  • RIV/00216208:11310/12:10191806
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  • equilibrium constants; encapsulation; production abundances; endohedral fullerenes (en)
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  • [845167EB2A0A]
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  • Akasaka, Takeshi
  • Nagase, Shigeru
  • Uhlík, Filip
  • Slanina, Zdenek
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  • 000317113600208
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issn
  • 0094-243X
number of pages
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  • 10.1063/1.4772133
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  • AMER INST PHYSICS
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  • 978-0-7354-1122-7
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  • 11310
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