𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Rotational-vibrational relative equilibria and the structure of quantum energy spectrum of the tetrahedral moleculeP4

✍ Scribed by Ch. van Hecke; D.A. Sadovskií; B.I. Zhilinskií; V. Boudon

Publisher
Springer
Year
2001
Tongue
English
Weight
945 KB
Volume
17
Category
Article
ISSN
1434-6060

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

The molecular structure and vibrational
The molecular structure and vibrational spectrum of 4-chlorostyrene
✍ J.M. Granadino-Roldán; M. Fernández-Gómez; A. Navarro; U.A. Jayasooriya; R.G. Mo 📂 Article 📅 2006 🏛 Elsevier Science 🌐 English ⚖ 354 KB

The molecular structure and vibrational spectrum of 4-chlorostyrene have been investigated by ab initio and DFT calculations combined with infrared/Raman and Inelastic Neutron Scattering (INS) spectroscopies. The molecular geometry has been optimized at different levels of theory, RHF, MP2, B3LYP an