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根据建立在电子-声子相互作用基础上的Peierls 相变理论,利用形变势模型和半经验晶体轨道方法计算的能带结构数据,对一维有机导体tetrathiafulvalene-tetracyanoquinodimethane的Peierls相变温度进行了计算.并对其金属-绝缘体相变机制进行了讨论.
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关键词:
- 电子-声子相互作用 /
- Peierls相变温度 /
- 一维有机导体
According to Peierls phase transition theory based on the electron-phonon interaction, the Peierls phase transition temperature of a one-dimensional organic conductor tetrathiafulvalene-tetracyanoquinodimethane is computed using the deformation potential model with the data calculated by a semi-empirical crystal orbital method. The mechanism of the metal-insulator phase transition in this conductor is also discussed.-
Keywords:
- electron-phonon interaction /
- Peierls phase transition temperature /
- one-dimensional organic conductor







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