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Polymers and oligomers of carbon dioxide: ab initio and semiempirical calculations

✍ Scribed by Errol Lewars

Book ID
113258805
Publisher
Elsevier Science
Year
1996
Tongue
English
Weight
982 KB
Volume
363
Category
Article
ISSN
0166-1280

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Three complete sets of the isolated-pentagon-rule fullerene isomers are Ε½ . Ε½ . Ε½ . considered-C 7 species , C 19 species , and C 35 species . The interisomeric 80 86 88 Ε½ . separation energetics is essentially similar at semiempirical AM1, SAM1 and ab initio Ε½ . HFrSTO-3G, HFr3-21G, HFr4-31G level