✦ LIBER ✦

Ab initio MO study of adsorption of CO molecule on TiO2 surfaces

✍ Scribed by Hisayoshi Kobayashi; Masaru Yamaguchi

Publisher: Elsevier Science
Year: 1989
Weight: 45 KB
Volume: 214
Category: Article
ISSN: 0167-2584
DOI: 10.1016/0167-2584(89)90950-x

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

An ab initio MO study of hydrogen adsorp

An ab initio MO study of hydrogen adsorption on LiF surfaces

✍ K. Matsumura; S. Yamabe; Y. Yanagisawa; R. Huzimura 📂 Article 📅 1981 🏛 Elsevier Science ⚖ 51 KB

Ab initio mo study of acetylene adsorbed

Ab initio mo study of acetylene adsorbed on Ni(111) surface

✍ Hisayoshi Kobayashi; Hiroyuki Teramae; Tokio Yamabe; Masaru Yamaguchi 📂 Article 📅 1984 🏛 Elsevier Science ⚖ 110 KB

Adsorption of thiophene on an MoS2 clust

Adsorption of thiophene on an MoS2 cluster model catalyst: ab initio density functional study

✍ Hideo Orita; Kunio Uchida; Naotsugu Itoh 📂 Article 📅 2003 🏛 Elsevier Science 🌐 English ⚖ 273 KB

A theoretical study of CO adsorption on

A theoretical study of CO adsorption on TiO2

✍ Adil Fahmi; Christian Minot 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 685 KB

Vinyl halides adsorbed on TiO2 surface:

Vinyl halides adsorbed on TiO2 surface: FTIR spectroscopy studies and ab initio calculations

✍ J. Scaranto; A. Pietropolli Charmet; P. Stoppa; S. Giorgianni 📂 Article 📅 2005 🏛 Elsevier Science 🌐 English ⚖ 261 KB

Clustering of NO2− with nitrous acid mol

Clustering of NO2− with nitrous acid molecules: Experimental and ab initio MO studies

✍ S. Włodek; H. Wincel 📂 Article 📅 1984 🏛 Elsevier Science 🌐 English ⚖ 526 KB

The gas-phase equilibria NO;.(HONO), \_, + HONO# NO?(HONO), were measured in a high-prrssurc mass spcctromc-1cr between 240 and 350 I(. The following enthalpy channgcs were detcrmined:A.H:,1 = -31. aHy.2 = -21.6 and A$ 3 = -20.3 kcal/mol. These results are discussed in rchtion to the structures of N