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Projects / Programmes source: ARIS

Elementarni procesi na površinah trdne snovi in v plinski fazi (Slovene)

Research activity

Code Science Field Subfield
1.04.01  Natural sciences and mathematics  Chemistry  Phyisical chemistry 

Code Science Field
P003  Natural sciences and mathematics  Chemistry 
P410  Natural sciences and mathematics  Theoretical chemistry, quantum chemistry 
Keywords
equilibrium structure, elementary processes, chemical kinetics, kinetic isotope effects, thermodynamics, quantum chemical methods and calculations, gas-surface interactions, surface science, transition metals, catalysis
Evaluation (rules)
source: COBISS
Researchers (7)
no. Code Name and surname Research area Role Period No. of publicationsNo. of publications
1.  03418  Jana Darinka Burger    Researcher  1999 - 2001  12 
2.  15723  Petra Dujmović    Researcher  1996 - 2001  81 
3.  02287  PhD Milan Hodošček  Chemistry  Researcher  1999 - 2001  281 
4.  01345  PhD Ivan Kobal  Chemistry  Researcher  1999 - 2001  478 
5.  16188  PhD Anton Kokalj  Chemistry  Researcher  1996 - 2001  377 
6.  08027  PhD Antonija Lesar  Chemistry  Head  1998 - 2001  121 
7.  12369  PhD Aleš Zupan  Physics  Researcher  1998 - 2001  25 
Organisations (1)
no. Code Research organisation City Registration number No. of publicationsNo. of publications
1.  0106  Jožef Stefan Institute  Ljubljana  5051606000  90,038 
Abstract
The aim of the project is the theoretical study of molecules and elementary steps in chemical reactions over nobel metal single crystal surfaces using quantum chemical methods. Particularly physico chemical parameters of individual systems and their interactions with metal surface of defined structure are calculated. Different absorption sites on the surface are available and a reliable identification of preferential reaction site can be obtained using our calculations.
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