𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Quantum Chemical Studies of the Adsorption of Thiophene on MOS2 Hydroprocessing Sites

✍ Scribed by J. Joffre; D. A. Lerner; P. Geneste


Publisher
Wiley (John Wiley & Sons)
Year
2010
Weight
320 KB
Volume
93
Category
Article
ISSN
0037-9646

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


A DFT quantum-chemical study on the stru
✍ Ivan I. Zakharov; Vladimir A. Zakharov; Alexandr G. Potapov; Georgii M. Zhidomir πŸ“‚ Article πŸ“… 1999 πŸ› John Wiley and Sons 🌐 English βš– 145 KB πŸ‘ 2 views

The electronic structure and geometry of polymethylaluminoxane (MAO) [ 1Al(CH 3 )O1 ] n with different size (n = 4 -12) have been studied using quantum-chemical DFT (density functional theory) calculations. It has been found: 1) Starting from n = 6, the three-dimensional oxo-bridged (cage) structure

Site Characterization on Reduced and on
✍ E. Delgado; G. A. Fuentes; C. Hermann; G. Kunzmann; H. KnΓΆzinger πŸ“‚ Article πŸ“… 2010 πŸ› Wiley (John Wiley & Sons) βš– 372 KB

Carbon monoxide adsorption on reduced and on sulfided Mo/AlzO3 was studied by gravi try and low temperature IR spectroscopy. CO and M?+-CO adsorption complexes are formed on H2-reduced and on sulfided catalysts, respectively. The saturation coverage by CO in the temperature range between 125 K and 2

Quantum chemical studies on structures a
✍ El-Nahas, Ahmed M.; Hammam, Essam; Ebeid, El-Zeiny M. πŸ“‚ Article πŸ“… 1998 πŸ› John Wiley and Sons 🌐 English βš– 250 KB πŸ‘ 2 views

Semiempirical MNDO and PM3 molecular orbital calculations have been undertaken to study the structures of the ground and excited states of 2,5-distrylpyrazine dye to assess its activity as a laser dye. In the ground and first excited singlet states, the trans-trans structure of C symmetry is the mos