| 书目名称 | Time-Dependent Density Functional Theory | | 编辑 | Miguel A.L. Marques,Carsten A. Ullrich,Eberhard K. | | 视频video | http://file.papertrans.cn/926/925525/925525.mp4 | | 概述 | The only textbook style volume on time-dependent DFT available. | | 丛书名称 | Lecture Notes in Physics | | 图书封面 |  | | 描述 | The year 2004 was a remarkable one for the growing ?eld of time-dependent density functional theory (TDDFT). Not only did we celebrate the 40th - niversary of the Hohenberg-Kohn paper, which had laid the foundation for ground-state density functional theory (DFT), but it was also the 20th - niversary of the work by Runge and Gross, establishing a ?rm footing for the time-dependent theory. Because the ?eld has grown to such prominence, and has spread to so many areas of science (from materials to biochemistry), we feel that a volume dedicated to TDDFT is most timely. TDDFT is based on a set of ideas and theorems quite distinct from those governingground-stateDFT,butemployingsimilar techniques.Itisfarmore than just applying ground-state DFT to time-dependent problems, as it - volves its own exact theorems and new and di?erent density functionals. Presently,themostpopularapplicationistheextractionofelectronicexcit- state properties, especially transition frequencies. By applying TDDFT after thegroundstateofamoleculehasbeenfound,wecanexploreandunderstand the complexity of its spectrum, thus providing much more information about the species. TDDFT has a especially strong impact in the p | | 出版日期 | Book 2006 | | 关键词 | DFT; TDDFT; chemistry; density fractionals; materials science; quantum chemistry | | 版次 | 1 | | doi | https://doi.org/10.1007/b11767107 | | isbn_softcover | 978-3-642-07128-7 | | isbn_ebook | 978-3-540-35426-0Series ISSN 0075-8450 Series E-ISSN 1616-6361 | | issn_series | 0075-8450 | | copyright | Springer-Verlag Berlin Heidelberg 2006 |
The information of publication is updating
|
|
|Archiver|手机版|小黑屋|
派博传思国际
( 京公网安备110108008328)
GMT+8, 2025-8-17 01:42
发表于 2025-3-21 19:54:31
