Time-dependent density functional theory: Past, present, and future
其他凝聚态物理
2007-05-23 v2 材料科学
摘要
Time-dependent density functional theory (TDDFT) is presently enjoying enormous popularity in quantum chemistry, as a useful tool for extracting electronic excited state energies. This article discusses how TDDFT is much broader in scope, and yields predictions for many more properties. We discuss some of the challenges involved in making accurate predictions for these properties.
引用
@article{arxiv.cond-mat/0410362,
title = {Time-dependent density functional theory: Past, present, and future},
author = {Kieron Burke and Jan Werschnik and E. K. U. Gross},
journal= {arXiv preprint arXiv:cond-mat/0410362},
year = {2007}
}
备注
12 pages, 4 figures