✦ LIBER ✦

The band spectrum of propynal at 4140 Å: Calculation of the structure from the Franck-Condon principle

✍ Scribed by C.T. Lin; D.C. Moule

Publisher: Elsevier Science
Year: 1971
Tongue: English
Weight: 731 KB
Volume: 38
Category: Article
ISSN: 0022-2852
DOI: 10.1016/0022-2852(71)90099-3

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

The band system of propynal at 4140 Å

✍ G.W. King; D. Moule 📂 Article 📅 1966 🏛 Elsevier Science 🌐 English ⚖ 629 KB

π-π∗ vibronic spectrum of ethylene from

π-π∗ vibronic spectrum of ethylene from ab initio calculations of the Franck-Condon factors

✍ Alexander M. Mebel; Yit-Tsong Chen; Sheng-Hsien Lin 📂 Article 📅 1996 🏛 Elsevier Science 🌐 English ⚖ 541 KB

The vibronic spectrum of ethylene corresponding to the rr-Tr \* N-V excitation has been studied using various ab initio methods. The vertical and adiabatic excitation energies, 8.1 and 5.6 eV, respectively, obtained at the highest level of theory, MRCI, are in close agreement with experiment and the

A theoretical study of the vibrational s

A theoretical study of the vibrational structure of the 2A1 band in NF3: Potential curves and Franck-Condon analysis

✍ Marc Papailhou; Claude Pouchan; Alain Dargelos 📂 Article 📅 1989 🏛 Elsevier Science 🌐 English ⚖ 594 KB

The potential energy surface of NF3 is interpreted by means of ab initio SCF CI calculations. The vibmnic structure of the first 2A, band is analyzed theoretically from an analytical function (polynomial+Gaussian) for the double-minimum potential. Frequencies and intensities computed within the Fran