著書
公開件数:6件
No. タイトル 著者 担当範囲 出版社 出版日 ISBN URL 概要
1 Approximate spin projection for broken-symmetry method and its application"
in Symmetry (Group Theory) and Mathematical Treatment in Chemistry
Y. Kitagawa, T. Saito, K. Yamaguchi

IntechOpen
2018



2 Electronic and Spin Structures of the CaMn4O5(H2O)4 Cluster in OEC of PSII Refined to 1.9 Å X-ray Resolution" Advances in Quantum Chemistry
S. Yamanaka*, K. Kanda, T. Saito, Y. Umena, K. Kawakami, J.-R. Shen, N. Kamiya, M. Okumura, H. Nakamura, K. Yamaguchi

Elsevier
2012



3 Density Functional Study of Manganese Complexes: Protonation Effects on Geometry and Magnetism” In Progess in Theoretical Chemistry and Physics
S. Yamanaka*, K. Kanda, T. Saito, Y. Kitagawa, T. Kawakami, M. Ehara, M. Okumura, H. Nakamura, K. Yamaguchi

Springer Verlag
2012



4 Calculation of Magnetic Properties and Spectroscopic Parameters of Manganese Clusters with Density Functional Theory” In Progess in Theoretical Chemistry and Physics
K. Kanda*, S. Yamanaka, T. Saito, Y. Kitagawa, T. Kawakami, M. Okumura, K. Yamaguchi

Springer Verlag
2012



5 “Approximate Spin Projection for Geometry Optimization of Biradical Systems: Case Studies of Through-Space and Through-Bond Systems” In Progess in Theoretical Chemistry and Physics
N. Yasuda, Y. Kitagawa*, H. Hatake, T. Saito, Y. Kataoka, T. Matsui, T. Kawakami, S. Yamanaka, M. Okumura, K. Yamaguchi

Springer Verlag
2012



6 エネルギー科学における多階層連結コンピューティング (第4章、分担執筆)


財団法人 国際高等研究所
2011/03/25
978-4-906671-85-4