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Does density functional theory contribute to the understanding of excited states of unsaturated organic compounds?

✍ Scribed by Tozer, David J.; Amos, Roger D.; Handy, Nicholas C.; Roos, Bjorn O.; Serrano-ANDRES, Luis


Book ID
115481932
Publisher
Taylor and Francis Group
Year
1999
Tongue
English
Weight
930 KB
Volume
97
Category
Article
ISSN
0026-8976

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Application of the Sakurai-Sugiura proje
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## Abstract The Sakurai‐Sugiura projection (SS) method was implemented and numerically assessed for diagonalization of the Hamiltonian in time‐dependent density functional theory (TDDFT). Since the SS method can be used to specify the range in which the eigenvalues are computed, it may be an effici