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Bibliography

Takano, Y., Taniguchi, T., Isobe, H., Kubo, T., Morita, Y., Yamamoto, K., Nakasuji, K., Takui, T., & Yamaguchi, K. (2002). Hybrid Density Functional Theory Studies on the Magnetic Interactions and the Weak Covalent Bonding for the Phenalenyl Radical Dimeric Pair. Journal of the American Chemical Society, 124(37), 11122–11130.

Authors 9
  1. Yu Takano (first)
  2. Takeshi Taniguchi (additional)
  3. Hiroshi Isobe (additional)
  4. Takashi Kubo (additional)
  5. Yasushi Morita (additional)
  6. Kagetoshi Yamamoto (additional)
  7. Kazuhiro Nakasuji (additional)
  8. Takeji Takui (additional)
  9. Kizashi Yamaguchi (additional)
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Dates
Type When
Created 22 years, 11 months ago (Sept. 11, 2002, 1:39 a.m.)
Deposited 3 years, 10 months ago (Oct. 11, 2021, 7:49 p.m.)
Indexed 2 months, 3 weeks ago (June 13, 2025, 3:47 a.m.)
Issued 23 years ago (Aug. 23, 2002)
Published 23 years ago (Aug. 23, 2002)
Published Online 23 years ago (Aug. 23, 2002)
Published Print 23 years ago (Sept. 1, 2002)
Funders 0

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@article{Takano_2002, title={Hybrid Density Functional Theory Studies on the Magnetic Interactions and the Weak Covalent Bonding for the Phenalenyl Radical Dimeric Pair}, volume={124}, ISSN={1520-5126}, url={http://dx.doi.org/10.1021/ja0177197}, DOI={10.1021/ja0177197}, number={37}, journal={Journal of the American Chemical Society}, publisher={American Chemical Society (ACS)}, author={Takano, Yu and Taniguchi, Takeshi and Isobe, Hiroshi and Kubo, Takashi and Morita, Yasushi and Yamamoto, Kagetoshi and Nakasuji, Kazuhiro and Takui, Takeji and Yamaguchi, Kizashi}, year={2002}, month=aug, pages={11122–11130} }