𝔖 Bobbio Scriptorium
✦   LIBER   ✦

The π,π* assignment of the lowest triplet state in the acetophenone crystal

✍ Scribed by Y. Tanimoto; H. Kobayashi; S. Nagakura; T. Azumi


Publisher
Elsevier Science
Year
1972
Tongue
English
Weight
339 KB
Volume
16
Category
Article
ISSN
0009-2614

No coin nor oath required. For personal study only.

✦ Synopsis


With the aid of the crystullographic data, obtained anew, the Zeeman splitting pattern observed with the longest wavelength singlet-to-triplet absorp!ion of the acetophenone single crystal has been analyzed. The optically active spin state is T,,, which is mixed by spin-orbit interaction with u,rr* singlet excited states. This result is only consistent with the rr,~i* assignment for the lowest triplet state.


📜 SIMILAR VOLUMES


On some properties of the lowest nπ* and
✍ C. Mijoule; P. Yvan 📂 Article 📅 1976 🏛 Elsevier Science 🌐 English ⚖ 391 KB

Scmi-cmpnlck~l calculations dre rcportcd for the lowest nn\* and BIT\* clcctromc triplet statcs of berwaldchydc. IIqulhbrmm gcomctrws, spin drpole-dlpolc and spin-orbIt contributions to the 2I.S paramcterr; ns well .IS oscillator strcngthP 1) + SO arc presented and discussed for both states.

Multiconfiguration wavefuntions for the
✍ Charles F. Bender; Thom.H. Dunning Jr.; Henry F. Schaefer III; William A. Goddar 📂 Article 📅 1972 🏛 Elsevier Science 🌐 English ⚖ 848 KB

Ab initio calculations have been carried out for the T(3B,u) and V('BIu) states of ethylene in a planar nuclear conf@ration. A "double-zeta" gaussian basis, augmented by diffuse functions, was used. A wide variety of configuration interaction wavefunctions (including as many as 1605 configurations)