✦ LIBER ✦

On the role of the conical intersection in H + H2 reactive scattering

✍ Scribed by Juan Carlos Juanes-Marcos; Stuart C. Althorpe

Book ID: 108107836
Publisher: Elsevier Science
Year: 2003
Tongue: English
Weight: 309 KB
Volume: 381
Category: Article
ISSN: 0009-2614
DOI: 10.1016/j.cplett.2003.10.041

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

A comparative infrared study of H2O reac

A comparative infrared study of H2O reactivity on Si(1 0 0)-(2 × 1), (2 × 1)-H, (1 × 1)-H and (3 × 1)-H surfaces

✍ G. Ranga Rao; Zhi-Hong Wang; Hidekazu Watanabe; Mutsumi Aoyagi; Tsuneo Urisu 📂 Article 📅 2004 🏛 Elsevier Science 🌐 English ⚖ 360 KB

Theoretical study of the stereodynamics

Theoretical study of the stereodynamics of the reactions of D− + H2 → H− + HD and H− + D2 → D− + HD

✍ Wen Liang Li; Mei Shan Wang; Chuanlu Yang; Wenwang Liu; Chao Sun; Tingqi Ren 📂 Article 📅 2007 🏛 Elsevier Science 🌐 English ⚖ 272 KB

Variational transition-state theory stud

Variational transition-state theory study of the D− + H2 → HD + H− reaction and the H− + D2 → HD + D− reaction

✍ Hongchao Luo; Ying Wu; Liping Ju 📂 Article 📅 2011 🏛 Elsevier 🌐 English ⚖ 368 KB

In the present paper, the variational transition-state theory (VTST) method has been used to carry out the dynamical calculations for the D À + H 2 ? HD + H À reaction and the H À + D 2 ? HD + D À reaction, respectively. The investigation of the variation of the potential energy curves and the bond

Assignment of surface IR absorption spec

Assignment of surface IR absorption spectra observed in the oxidation reactions: 2H + H2O/Si(1 0 0) and H2O + H/Si(1 0 0)

✍ Zhi-Hong Wang; Tsuneo Urisu; Hidekazu Watanabe; Kenta Ooi; G. Ranga Rao; Shinkoh 📂 Article 📅 2005 🏛 Elsevier Science 🌐 English ⚖ 328 KB

Stereodynamics of the reaction H +&

Stereodynamics of the reaction H + LiH (v = 0, j = 0) → H2 + Li and its isotopic variants

✍ Yufang Liu; Xiaohu He; Deheng Shi; Jinfeng Sun 📂 Article 📅 2011 🏛 Elsevier 🌐 English ⚖ 339 KB

Quasi-classical trajectory (QCT) method is used to calculate the stereodynamics of the reactions H + LiH (v = 0, j = 0) ? H 2 + Li and its isotopic variants based on the ground electronic state potential energy surface (PES) reported by Prudente et al. [14]. The reactive probabilities of the title r

Can water be a catalyst on the HO2 

Can water be a catalyst on the HO2 + H2O + O3 reactive cluster?

✍ Luís P. Viegas; António J.C. Varandas 📂 Article 📅 2012 🏛 Elsevier Science 🌐 English ⚖ 415 KB

On the role of the conical intersection in H&#xa0;+&#xa0;H2 reactive scattering

On the role of the conical intersection in H + H2 reactive scattering