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Ab initio study of C4O4 in Td symmetry

โœ Scribed by Stefano Evangelisti


Book ID
107736622
Publisher
Elsevier Science
Year
1996
Tongue
English
Weight
255 KB
Volume
259
Category
Article
ISSN
0009-2614

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Structures, energies and vibrational hquencies have been calculated for hollow cage clusters N28, B4N24, B12N16, and B16Nl2 with Td symmetry using ab initw quantum mechanical methods at the RHF/3-21G level. Each species is predicted to be both chemically and kinetically stable. Skeletal polyhedrons