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Electronic structures of models for alkylene-aromatic polymers and their pyrolysis products

✍ Scribed by Kazuyoshi Tanaka; Shoji Yamashita; Masanori Kitamura; Tokio Yamabe


Book ID
104175972
Publisher
Elsevier Science
Year
1990
Tongue
English
Weight
502 KB
Volume
17
Category
Article
ISSN
0165-2370

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## Ž . A comparison of DFT᎐LSD᎐CGA DZVPrA1 and DZVP2rA2 and restricted Ž . Ž . Hartree᎐Fock RHF 6-31G and 6-311G\*\* results on geometries, dipole moments, and electric polarizabilities of a series of molecules incorporating quinoid or phenyl groups in the skeleton is reported. DFT results, obtain