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Formation of HeH+ by radiative association of He+ + H. An advanced ab initio study

✍ Scribed by W.P. Kraemer; V. Špirko; M. Juřek


Book ID
103031917
Publisher
Elsevier Science
Year
1995
Tongue
English
Weight
607 KB
Volume
236
Category
Article
ISSN
0009-2614

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An ab initio study of the formation and
✍ Tae-Kyu Ha; Minh Tho Nguyen 📂 Article 📅 1983 🏛 Elsevier Science 🌐 English ⚖ 359 KB

The energy difference between the HzCN\*-N2 comples and its components, H2CN\* 2nd N2. has been ulculated PS 89 and 6-4 kcal/mol by ab initio SW calculations employing the 4-31G and 6-31G\*\* basis sets. These ~AICS agree with the previously estimated heat of formation of 7.65 kul/mol. The reaction