𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Theoretical study of the possible isomers and high-energy intermediates of HCNH2O complexes

✍ Scribed by A.C. Samuels; J.O. Jensen; P.N. Krishnan; Luke A. Burke


Book ID
114142698
Publisher
Elsevier Science
Year
1998
Tongue
English
Weight
748 KB
Volume
427
Category
Article
ISSN
0166-1280

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Theoretical study of the H2O2CO hydroge
✍ Jan Lundell; Markku Räsänen; Zdzislaw Latajka 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 533 KB

Ab initio SCF and MP2 calculations have been performed on the structural and energetic properties of HsO-2C0. Three possible energy minima were found, all forming almost linear hydrogen bonds. The most stable species was observed when both carbon monoxide monomers were attached to water via the carb

Theoretical study of the CH bond dissoc
✍ Charles W. Bauschlicher Jr.; Stephen R. Langhoff 📂 Article 📅 1991 🏛 Elsevier Science 🌐 English ⚖ 554 KB

The successive C-H bond dissociation energies of CH,, &Hz. C2H4, and H&O (ketene) are determined using large basis sets and a high level of correlation treatment. For CHI, C2H2, and C2H4 the computed values are in excellent agreement with experiment. Using our results we recommend 107.9 +2.0 and 96.