四面体型金属錯体におけるスピンクロスオーバー現象の電子論的予測

岩倉正訓, 松嶋領, 渡邉僚介, 石井知彦, 坂根弦太, 小笠原一禎

槌田龍太郎の分光化学系列, 田辺・菅野ダイアグラム, DV-Xα法
Metal complexes exhibit a characteristic magnetic properties.  Most of the various physical properties and phenomena of the metal complexes, can be explained by a ligand field theory.  Tsuchida's spectrochemical series (SCS) and Tanabe-Sugano diagram (TSD) are very often used as an indicator of the ligand field splitting for the discussion of the absorption spectrum and the magnetic properties observed in metal complexes.  In this study, we have created completely novel diagrams unprecedented that a combination of SCS and TSD, in the case of a tetrahedral symmetrical metal complex.

Bulletin of the Society for Discrete Variational Xα

The Society for Discrete Variational Xα

26

1&2

200

204