| Yazarlar (3) |
İskender Muz
Nevşehir Hacı Bektaş Veli Üniversitesi, Türkiye |
Prof. Dr. Emine TANIŞ
Kırşehir Ahi Evran Üniversitesi, Türkiye |
|
Niyazi Bulut
Fırat Üniversitesi, Türkiye |
| Özet |
| Integral cross-sections and rate constants of the H{sup +}+H{sub 2{yields}} H{sub 2}{sup +}+H reaction have been computed by using a wave packet and a quasi classical trajectory (QCT) method. For the dynamic and kinetic calculations of the title reaction the ab initio potential energy surface (PES) of Aguado et al. has been used. The calculated total reaction cross sections shows no any threshold like an abstraction reaction. The value of the total cross sections for all specific j quantum states are decrease with increasing collision energy. State specific rate constants do not display an Arrhenius behavior and are not sensitive to the temperature range of working. The calculated results with QCT are found to be well consistent with the quantum mechanical wave packet results |
| Anahtar Kelimeler |
| Bildiri Türü | Tebliğ/Bildiri |
| Bildiri Alt Türü | Özet Metin Olarak Yayınlanan Tebliğ (Uluslararası Kongre/Sempozyum) |
| Bildiri Niteliği | Alanında Hakemli Uluslararası Kongre/Sempozyum |
| Bildiri Dili | İngilizce |
| Kongre Adı | 26 th International Physics Congress |
| Kongre Tarihi | 24-09-2009 / 27-09-2009 |
| Basıldığı Ülke | |
| Basıldığı Şehir |
