Retardation in electron dynamics simulations based on time-dependent density functional theory

被引:0
|
作者
Xiaojing Wu
Aurelio Alvarez-Ibarra
Dennis R. Salahub
Aurélien de la Lande
机构
[1] Laboratoire de Chimie Physique,Department of Chemistry
[2] Université Paris Sud – CNRS. Université Paris Saclay,undefined
[3] Centre for Molecular Simulation,undefined
[4] Institute for Quantum Science and Technology and Quantum Alberta,undefined
[5] University of Calgary,undefined
[6] College of Chemistry and Chemical Engineering,undefined
[7] Henan University of Technology,undefined
来源
关键词
D O I
暂无
中图分类号
学科分类号
摘要
引用
收藏
相关论文
共 50 条
  • [41] Memory in time-dependent density functional theory
    Maitra, NT
    Burke, K
    Woodward, C
    PHYSICAL REVIEW LETTERS, 2002, 89 (02)
  • [42] Time-Dependent Multilevel Density Functional Theory
    Giovannini, Tommaso
    Scavino, Marco
    Koch, Henrik
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2024, 20 (09) : 3601 - 3612
  • [43] Existence of time-dependent density-functional theory for open electronic systems: Time-dependent holographic electron density theorem
    Zheng, Xiao
    Yam, ChiYung
    Wang, Fan
    Chen, GuanHua
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2011, 13 (32) : 14358 - 14364
  • [44] Time-dependent density-functional theory
    Rubio, Angel
    Marques, Miguel
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2009, 11 (22) : 4436 - 4436
  • [45] Time-dependent density-functional theory
    Dobson, JF
    ELECTRONIC DENSITY FUNCTIONAL THEORY: RECENT PROGRESS AND NEW DIRECTIONS, 1998, : 43 - 53
  • [46] Tackling radiationless decay by non-adiabatic molecular dynamics simulations and time-dependent density functional theory
    Furche, Filipp
    Tapavicza, Enrico
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2012, 244
  • [47] Nonadiabatic molecular dynamics simulations based on time-dependent density functional tight-binding method
    Wu, Xiaoyan
    Wen, Shizheng
    Song, Huajing
    Frauenheim, Thomas
    Tretiak, Sergei
    Yam, ChiYung
    Zhang, Yu
    JOURNAL OF CHEMICAL PHYSICS, 2022, 157 (08):
  • [48] First-principles simulations for attosecond photoelectron spectroscopy based on time-dependent density functional theory
    Shunsuke A. Sato
    Hannes Hübener
    Angel Rubio
    Umberto De Giovannini
    The European Physical Journal B, 2018, 91
  • [49] First-principles simulations for attosecond photoelectron spectroscopy based on time-dependent density functional theory
    Sato, Shunsuke A.
    Huebener, Hannes
    Rubio, Angel
    De Giovannini, Umberto
    EUROPEAN PHYSICAL JOURNAL B, 2018, 91 (06):
  • [50] Real-Time Exciton Dynamics with Time-Dependent Density-Functional Theory
    Sun, Jiuyu
    Lee, Cheng-Wei
    Kononov, Alina
    Schleife, Andre
    Ullrich, Carsten A.
    PHYSICAL REVIEW LETTERS, 2021, 127 (07)