Title of article :
The March model applied to boron cages
Author/Authors :
Amovilli، نويسنده , , C. and March، نويسنده , , N.H.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2001
Pages :
6
From page :
459
To page :
464
Abstract :
The so-called March model of fullerene, in which a self-consistent spherical distribution of π electrons is combined with the proper nuclear–nuclear potential energy for the correct structure, is here extended to boron cages. The Thomas–Fermi approximation of the initial studies is here replaced by Hartree–Fock calculations. Explicit results for B2k and B2k+1+, with k ranging from 15 to 27, are discussed and compared with calculations on similar clusters found in the literature.
Journal title :
Chemical Physics Letters
Serial Year :
2001
Journal title :
Chemical Physics Letters
Record number :
1778200
Link To Document :
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