Stability of bipolarons, electron-electron correlations, the variational principle, and the virial theorem

被引:6
|
作者
Mukhomorov, VK [1 ]
机构
[1] Russian Acad Agr Sci, Res Inst Agrophys, St Petersburg 195220, Russia
关键词
D O I
10.1134/S1063783406050088
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
For bipolaron states, a relation is established between the variational principle and the virial theorem optimizing the electronic wave functions. It is shown that a bipolaron one-center state is unstable under any conditions that do not violate basic physical principles. It is established that a stage-by-stage increase in the flexibility of the electronic wave function due to the electron-electron correlations does not stabilize a one-center bipolaron. It is argued that the results of calculations based on the one-center bipolaron model are incorrect.
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页码:864 / 870
页数:7
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