Addition to “Practical Training in Simple Hückel Theory: Matrix Diagonalization via Tridiagonalization, Cyclobutadiene, and Visualization of Molecular Orbitals”

This paper is an addition to the article "Practical Training in Simple Huckel Theory: Matrix Diagonalization for Highly Symmetric Molecules and Visualization of Molecular Orbitals" by Shin-ichi Nagaoka, Tatsunobu Kokubo, Hiroyuki Teramae, and Umpei Nagashima.(l). Yoshinori Yamasaki, from t...

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Veröffentlicht in:Journal of chemical education 2020-08, Vol.97 (8), p.2373-2374
Hauptverfasser: Nagaoka, Shin-ichi, Yamasaki, Yoshinori, Teramae, Hiroyuki, Nagashima, Umpei, Kokubo, Tatsunobu
Format: Artikel
Sprache:eng
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Zusammenfassung:This paper is an addition to the article "Practical Training in Simple Huckel Theory: Matrix Diagonalization for Highly Symmetric Molecules and Visualization of Molecular Orbitals" by Shin-ichi Nagaoka, Tatsunobu Kokubo, Hiroyuki Teramae, and Umpei Nagashima.(l). Yoshinori Yamasaki, from the Department of Mathematics, Faculty of Science and Graduate School of Science and Engineering, Ehime University, Matsuyama 790-8577, Japan, is an author of this addition, together with the authors of the original article. With the addition, the new title of this work is "Practical Training in Simple Huckel Theory: Matrix Diagonalization via Tridiagonalization, Cyclobutadiene, and Visualization of Molecular Orbitals".
ISSN:0021-9584
1938-1328
DOI:10.1021/acs.jchemed.0c00857