Quantum mechanics calculations at B3LYP/6-31G (d)//HF/3-21G (d) level of the theory were carried out on second generation dendritic polyacetylenic oligomers bearing different terminal groups to clarify the impact of their nature on the electronic structure of hyperbranched polyacetylene. It was foun
Hubbard Effect on Soliton Motion of Polyacetylene
โ Scribed by Ling-Yun Zhang; Jia-Tih Lin; Hong Sun
- Publisher
- John Wiley and Sons
- Year
- 1999
- Tongue
- English
- Weight
- 230 KB
- Volume
- 212
- Category
- Article
- ISSN
- 0370-1972
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