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期刊论文
Electron-electron interactions and solitons in polyacetylene
PHYSICAL REVIEW B VOLUME 46, NUMBER 10 1 SEPTEMBER 1992-Ⅱ,-0001,():
The electron.. electron interactions and the creation energy of a soliton in highly conducting polymers were calculated by using a correlated--basis-function method with a general screening Coulomb potential within the Kronig. Penny. model framework. Our results showed that even when the electron-electron interactions are considered,solitons are still the main charge carriers. The strong long-range electron-electron interaction is seen to reduce the creation energy of a soliton. A comparison with results based on the Hubbard model has been made. The 1imitations of the Hubbard model in this application were discussed.
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