The transfer of energy between electrons and ions in solids

被引:67
作者
Horsfield, A. P.
Bowler, D. R.
Ness, H.
Sanchez, C. G.
Todorov, T. N.
Fisher, A. J.
机构
[1] UCL, Dept Phys & Astron, London WC1E 6BT, England
[2] UCL, London Ctr Nanotechnol, London WC1E 6BT, England
[3] CEA Saclay, DRECAM, DSM, Serv Phys & Chim Surfaces & Interfaces, F-91191 Gif Sur Yvette, France
[4] Univ Nacl Cordoba, Fac Ciencias Quim, INFIQC, Unidad Matemat & Fis, RA-5000 Cordoba, Argentina
[5] Queens Univ Belfast, Sch Math & Phys, Belfast BT7 1NN, Antrim, North Ireland
关键词
D O I
10.1088/0034-4885/69/4/R05
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
In this review we consider those processes in condensed matter that involve the irreversible flow of energy between electrons and nuclei that follows from a system being taken out of equilibrium. We survey some of the more important experimental phenomena associated with these processes, followed by a number of theoretical techniques for studying them. The techniques considered are those that can be applied to systems containing many nonequivalent atoms. They include both perturbative approaches (Fermi's Golden Rule and non-equilibrium Green's functions) and molecular dynamics based (the Ehrenfest approximation, surface hopping, semi-classical Gaussian wavefunction methods and correlated electron-ion dynamics). These methods are described and characterized, with indications of their relative merits.
引用
收藏
页码:1195 / 1234
页数:40
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