𝔖 Bobbio Scriptorium
✦   LIBER   ✦

A theoretical study of the methanetriol decomposition mechanism

✍ Scribed by Stanislav Böhm; Imke Senf; Hans-Dieter Schädler; Josef Kuthan


Book ID
113257713
Publisher
Elsevier Science
Year
1992
Tongue
English
Weight
569 KB
Volume
253
Category
Article
ISSN
0166-1280

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Study of methanetriol decomposition mech
✍ Stanislav Böhm; Diana Antipova; Josef Kuthan 📂 Article 📅 1996 🏛 John Wiley and Sons 🌐 English ⚖ 478 KB 👁 2 views

Using ab initio HF/6-31G\*\* and MP2/6-31G\*\* calculations alternative reactions HC(OH), + HCO,H + H,O and HC(OH), + H,O + HCO,H + 2H,O are investigated and the results are compared with relevant PM3, HF/

Theoretical Study of the Unimolecular De
✍ Shao-Kun Wang; Qing-Zhu Zhang; Hua Hou; Bin Wang; Fu-Xiang Liu; Yue-Shu Gu 📂 Article 📅 2010 🏛 John Wiley and Sons 🌐 English ⚖ 278 KB

## Abstract The decomposition pathways of chloromethanol have been studied by __ab initio__ calculation. Equilibriums and transition states have been optimized at the UMP2(full)/6–31G(d) level. The single point energies have been obtained at higher level of G3 (MP2). Four transition states and eigh