抄録
The electronic structure and the magnetic property of stacked diphenylcarbene polymer have been theoretically studied using the unrestricted Hartree-Fock crystal orbital method. It has been revealed that the ferromagnetic interplane interaction is anticipated for the translation pitch angles of θ=60° and 180° to give ferromagnetic array throughout the polymer in contrast with the antiferromagnetic interaction for θ = 120°. Futhermore, more realistic polymer conformation based on the observed polycrystalline structure of diphenylcarbene derivatives was also examined.
| 元の言語 | 英語 |
|---|---|
| ページ（範囲） | 1-8 |
| ページ数 | 8 |
| ジャーナル | Synthetic Metals |
| 巻 | 44 |
| 発行部数 | 1 |
| DOI | |
| 出版物ステータス | 出版済み - 1 1 1991 |
| 外部発表 | Yes |
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All Science Journal Classification (ASJC) codes
- Electronic, Optical and Magnetic Materials
- Materials Chemistry
- Polymers and Plastics
これを引用
Theoretical study on ferromagnetic interaction in stacked diphenylcarbene polymer. / Tanaka, Kazuyoshi; Takeuchi, Tomonari; Yoshizawa, Kazunari; Toriumi, Michio; Yamabe, Tokio.
：: Synthetic Metals, 巻 44, 番号 1, 01.01.1991, p. 1-8.研究成果: ジャーナルへの寄稿 › 記事
}
TY - JOUR
T1 - Theoretical study on ferromagnetic interaction in stacked diphenylcarbene polymer
AU - Tanaka, Kazuyoshi
AU - Takeuchi, Tomonari
AU - Yoshizawa, Kazunari
AU - Toriumi, Michio
AU - Yamabe, Tokio
PY - 1991/1/1
Y1 - 1991/1/1
N2 - The electronic structure and the magnetic property of stacked diphenylcarbene polymer have been theoretically studied using the unrestricted Hartree-Fock crystal orbital method. It has been revealed that the ferromagnetic interplane interaction is anticipated for the translation pitch angles of θ=60° and 180° to give ferromagnetic array throughout the polymer in contrast with the antiferromagnetic interaction for θ = 120°. Futhermore, more realistic polymer conformation based on the observed polycrystalline structure of diphenylcarbene derivatives was also examined.
AB - The electronic structure and the magnetic property of stacked diphenylcarbene polymer have been theoretically studied using the unrestricted Hartree-Fock crystal orbital method. It has been revealed that the ferromagnetic interplane interaction is anticipated for the translation pitch angles of θ=60° and 180° to give ferromagnetic array throughout the polymer in contrast with the antiferromagnetic interaction for θ = 120°. Futhermore, more realistic polymer conformation based on the observed polycrystalline structure of diphenylcarbene derivatives was also examined.
UR - http://www.scopus.com/inward/record.url?scp=0026190434&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=0026190434&partnerID=8YFLogxK
U2 - 10.1016/0379-6779(91)91852-2
DO - 10.1016/0379-6779(91)91852-2
M3 - Article
VL - 44
SP - 1
EP - 8
JO - Synthetic Metals
JF - Synthetic Metals
SN - 0379-6779
IS - 1
ER -