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Renner−Teller Effect in C 2 H 2+ (X 2 Π u ) Studied by Rotationally Resolved Zero Kinetic Energy Photoelectron Spectroscopy

✍ Scribed by Yang, Jie; Mo, Yuxiang


Book ID
126903901
Publisher
American Chemical Society
Year
2006
Tongue
English
Weight
335 KB
Volume
110
Category
Article
ISSN
1089-5639

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Ab Initio Study of the Renner-Teller Eff
✍ M. Peric; B. Engels; S.D. Peyerimhoff 📂 Article 📅 1995 🏛 Elsevier Science 🌐 English ⚖ 425 KB

A variational approach is applied to calculate the vibronic energy levels and the corresponding wavefunctions for the \(X^{2} I_{u}\) electronic state of \(\mathrm{B}_{2} \mathrm{H}_{2}^{+}\). The potential surfaces involving variations of the symmetric B-H stretching, B-B stretching, trans- and cis