Time-dependent density-functional theory for strong-field multiphoton processes: Application to the study of the role of dynamical electron correlation in multiple high-order harmonic generation | |
Tong, XM ; Chu, SI | |
刊名 | PHYSICAL REVIEW A |
1998 | |
卷号 | 57期号:1页码:452 |
关键词 | INTENSE LASER FIELDS MOLECULAR STABILIZATION SCHRODINGER-EQUATION EXCHANGE-ENERGY SPECTRAL METHOD IONIZATION ACCURATE SYSTEMS HELIUM APPROXIMATIONS |
ISSN号 | 1050-2947 |
通讯作者 | Tong, XM (reprint author), Univ Kansas, Dept Chem, Lawrence, KS 66045 USA. |
中文摘要 | We present a self-interaction-free time-dependent density-functional theory (TDDFT) for nonperturbative treatment of multiphoton processes of many-electron atomic systems in intense laser fields. The theory is based on the extension of the time-dependent Kohn-Sham formalism. The time-dependent exchange-correlation potential with proper short-and long-range behavior is constructed by means of the time-dependent optimized effective potential (TDOEP) method and the incorporation of an explicit self-interaction correction (SIC) term. The resulting TDOEP-SIC equations are structurally similar to the time-dependent Wartree-Fock equations, but include the many-body effects through an orbital-independent single-particle local time-dependent exchange-correlation potential. We also introduce a generalized pseudospectral lime-propagation method, allowing optimal spatial grid discretization, for accurate and efficient numerical solution of the TDOEP-SIC equations. The theory is applied to the study of the role of dynamical electron correlation on the multiple high-order harmonic generation (HHG) processes of He atoms in intense laser fields. We also perform a detailed study of the mechanisms responsible for the production of the higher harmonics in He atoms observed in a recent experiment that cannot be explained by the single-active-electron model. We found that both the dynamical electron correlation and the He+ ion are important to the generation of the observed higher harmonics. The present TDDFT is thus capable of providing a unified and self-consistent dynamical picture of the HHG processes. [S1050-2947(98)04601-0]. |
收录类别 | SCI |
语种 | 英语 |
公开日期 | 2013-09-23 |
内容类型 | 期刊论文 |
源URL | [http://ir.iphy.ac.cn/handle/311004/45914] |
专题 | 物理研究所_物理所公开发表论文_物理所公开发表论文_期刊论文 |
推荐引用方式 GB/T 7714 | Tong, XM,Chu, SI. Time-dependent density-functional theory for strong-field multiphoton processes: Application to the study of the role of dynamical electron correlation in multiple high-order harmonic generation[J]. PHYSICAL REVIEW A,1998,57(1):452. |
APA | Tong, XM,&Chu, SI.(1998).Time-dependent density-functional theory for strong-field multiphoton processes: Application to the study of the role of dynamical electron correlation in multiple high-order harmonic generation.PHYSICAL REVIEW A,57(1),452. |
MLA | Tong, XM,et al."Time-dependent density-functional theory for strong-field multiphoton processes: Application to the study of the role of dynamical electron correlation in multiple high-order harmonic generation".PHYSICAL REVIEW A 57.1(1998):452. |
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