𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Laser induced desorption of NO from NiO(100): Characterization of potential energy surfaces of excited states

✍ Scribed by T. Klüner; H.-J. Freund; J. Freitag; V. Staemmler


Book ID
104423353
Publisher
Elsevier Science
Year
1997
Tongue
English
Weight
865 KB
Volume
119
Category
Article
ISSN
1381-1169

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Simulation of laser-induced desorption o
✍ C. Bach; T. Klüner; A. Groß 📂 Article 📅 2003 🏛 Elsevier Science 🌐 English ⚖ 225 KB

We have implemented a mixed quantum-classical scheme for the simulation of the laser-induced desorption from surfaces. This method allows a multidimensional simulation of the desorption process on realistic time scales. Using ab initio derived potential energy surfaces, we compare the mixed quantum-

Rotation–vibration energy levels from re
✍ D. Belmiloud; M. Jacon 📂 Article 📅 2000 🏛 John Wiley and Sons 🌐 English ⚖ 149 KB 👁 2 views

Using recently published potential energy surfaces, rovibrational energy levels are computed for the ground electronic states of H O and NO , using three-2 2 Ž . dimensional discrete variable representation DVR algorithms. Calculations are presented for H O to demonstrate the accuracy of these algor