Generalization of the Projection Space Improves the SAC-SD (symmetry-adapted cluster-singles and doubles) Method in Bond-breaking Systems

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概要

• 論文の詳細を見る
• 2005-10-05

著者

• Hasegawa Jun-ya

  Department Of Synthetic Chemistry And Biological Chemistry Graduate School Of Engineering Kyoto Univ

• Nakatsuji Hiroshi

  Fukui Institute For Fundamental Chemistry Kyoto University

• Hasegawa Jun-ya

  Quantum Chemistry Res. Inst. (qcri)

関連論文

• Theoretical Investigation on the Origin of the CD Signal Reversal for the Closed-ring Isomer of Diarylethene with Peripherical π-Conjugated Substituents
• Circular Dichroism and Absorption Spectroscopy for Three-Membered Ring Compounds Using Symmetry-Adapted Cluster-Configuration Interaction (SAC-CI) Method
• Color Tuning Mechanism of Human Red, Green, and Blue Cone Pigments : SAC-CI Theoretical Study
• Generalization of the Projection Space Improves the SAC-SD (symmetry-adapted cluster-singles and doubles) Method in Bond-breaking Systems

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