𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Ab initio computation of the UV resonance Raman intensity pattern of aqueous imidazole

✍ Scribed by Andrzej A. Jarzȩcki; Thomas G. Spiro

Publisher
John Wiley and Sons
Year
2001
Tongue
English
Weight
191 KB
Volume
32
Category
Article
ISSN
0377-0486

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Ab initio calculations of the ultraviole
Ab initio calculations of the ultraviolet resonance Raman spectra of uracil
✍ Warner L. Peticolas; Thomas Rush III 📂 Article 📅 1995 🏛 John Wiley and Sons 🌐 English ⚖ 673 KB

An equation been derived to calculate, ab inifio, the frequencies and intensities of a resonant Raman spectrum from the transform theory of resonance Raman scattering. This equation has been used to calculate the intensities of the ultraviolet resonance Raman spectra from the first n -~\* excited st

Resonance Raman spectroscopy as a test o
Resonance Raman spectroscopy as a test of ab initio methods for the computation of molecular potential energy surfaces
✍ Bruce S. Hudson; Laura M. Markham 📂 Article 📅 1998 🏛 John Wiley and Sons 🌐 English ⚖ 358 KB 👁 2 views

The use of ab initio quantum chemical methods to aid in the interpretation of resonance Raman spectra is illustrated with examples where the resonant electronic absorption spectra are unstructured. In such cases only the gradient of the excited electronic state potential energy surface at the ground

Correlation between the UV resonance Ram
Correlation between the UV resonance Raman intensity and hydrogen bonding of the adenine ring
✍ Akira Toyama; Kazuo Ohta; Hideo Takeuchi 📂 Article 📅 2005 🏛 Elsevier Science 🌐 English ⚖ 212 KB

The absorption and UV resonance Raman spectra of 2 0 ,3 0 ,5 0 -tri-O-acetyladenosine (AcAdo) were investigated in two non-hydrogenbonding, three proton acceptor, and four proton donor/acceptor solvents. The molar extinction coefficient at the absorption maximum around 260 nm (3 max ) changed up to