共 22 条
Many-body effects of dispersion interaction
被引:67
作者:
Donchev, A. G.
[1
]
机构:
[1] Algodign LLC, Moscow 123001, Russia
关键词:
D O I:
10.1063/1.2337283
中图分类号:
O64 [物理化学(理论化学)、化学物理学];
学科分类号:
070304 ;
081704 ;
摘要:
The role of many-body (MB) dispersion forces have been analyzed for strands, films, and cubic lattices in the framework of a model Hamiltonian that allows exact solution of the multiparticle Shrodinger equation. For the systems investigated the MB contribution may be as large as 7% of specific dispersion energy and 11% of solvation energy. Nonadditivity becomes particularly important for aggregation in solution, where its effect may be several times larger than the pairwise contribution. For all systems considered, the three-body Axilrod-Teller approximation was insufficient to predict the magnitude and in some cases even the sign of the full MB effect. (c) 2006 American Institute of Physics.
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