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Density-functional methods for excited states[electronic resource] /

紀錄類型:	書目-語言資料,印刷品 : Monograph/item
杜威分類號:	541.28
書名/作者:	Density-functional methods for excited states/ edited by Nicolas Ferre, Michael Filatov, Miquel Huix-Rotllant.
其他作者:	Ferre, Nicolas.
出版者:	Cham : : Springer International Publishing :, 2016.
面頁冊數:	xii, 481 p. : : ill. (some col.), digital ;; 24 cm.
Contained By:	Springer eBooks
標題:	Density functionals.
標題:	Excited state chemistry.
標題:	Quantum chemistry.
標題:	Chemistry.
標題:	Theoretical and Computational Chemistry.
標題:	Physical Chemistry.
標題:	Spectroscopy/Spectrometry.
ISBN:	9783319220819
ISBN:	9783319220802
內容註:	From the Contents: Current status and recent developments in linear response TD-DFT -- Density matrix functional theory (DMFT) and linear response time-dependent DMFT (TD-DMFT) for excited states -- Ensemble DFT for strongly correlated molecules and excited states.
摘要、提要註:	The series Topics in Current Chemistry presents critical reviews of the present and future trends in modern chemical research. The scope of coverage is all areas of chemical science including the interfaces with related disciplines such as biology, medicine and materials science. The goal of each thematic volume is to give the non-specialist reader, whether in academia or industry, a comprehensive insight into an area where new research is emerging which is of interest to a larger scientific audience. Each review within the volume critically surveys one aspect of that topic and places it within the context of the volume as a whole. The most significant developments of the last 5 to 10 years are presented using selected examples to illustrate the principles discussed. The coverage is not intended to be an exhaustive summary of the field or include large quantities of data, but should rather be conceptual, concentrating on the methodological thinking that will allow the non-specialist reader to understand the information presented. Contributions also offer an outlook on potential future developments in the field. Review articles for the individual volumes are invited by the volume editors. Readership: research chemists at universities or in industry, graduate students.
電子資源:	http://dx.doi.org/10.1007/978-3-319-22081-9

Density-functional methods for excited states[electronic resource] /
Density-functional methods for excited states[electronic resource] /edited by Nicolas Ferre, Michael Filatov, Miquel Huix-Rotllant. - Cham :Springer International Publishing :2016. - xii, 481 p. :ill. (some col.), digital ;24 cm. - Topics in current chemistry,3680340-1022 ;. - Topics in current chemistry ;307..

From the Contents: Current status and recent developments in linear response TD-DFT -- Density matrix functional theory (DMFT) and linear response time-dependent DMFT (TD-DMFT) for excited states -- Ensemble DFT for strongly correlated molecules and excited states.

The series Topics in Current Chemistry presents critical reviews of the present and future trends in modern chemical research. The scope of coverage is all areas of chemical science including the interfaces with related disciplines such as biology, medicine and materials science. The goal of each thematic volume is to give the non-specialist reader, whether in academia or industry, a comprehensive insight into an area where new research is emerging which is of interest to a larger scientific audience. Each review within the volume critically surveys one aspect of that topic and places it within the context of the volume as a whole. The most significant developments of the last 5 to 10 years are presented using selected examples to illustrate the principles discussed. The coverage is not intended to be an exhaustive summary of the field or include large quantities of data, but should rather be conceptual, concentrating on the methodological thinking that will allow the non-specialist reader to understand the information presented. Contributions also offer an outlook on potential future developments in the field. Review articles for the individual volumes are invited by the volume editors. Readership: research chemists at universities or in industry, graduate students.

ISBN: 9783319220819

Standard No.: 10.1007/978-3-319-22081-9doiSubjects--Topical Terms:

394283
Density functionals.

LC Class. No.: QD462.6.D45

Dewey Class. No.: 541.28

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