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Structural, electronic, and magnetic properties of [Fe.sub.3][C.sub.2] cluster
- Source :
- Journal of Physical Chemistry A. May 22, 2008, Vol. 112 Issue 20, 4556-4561
- Publication Year :
- 2008
-
Abstract
- Twenty stable geometries of [Fe.sub.3][C.sub.2] are found using spinpolarized DFT calculations. The stability of all clusters is confirmed by vibrational frequency analysis.
Details
- Language :
- English
- ISSN :
- 10895639
- Volume :
- 112
- Issue :
- 20
- Database :
- Gale General OneFile
- Journal :
- Journal of Physical Chemistry A
- Publication Type :
- Academic Journal
- Accession number :
- edsgcl.181917389