ISSN:
1432-2234
Keywords:
MINDO/SR
;
Nickel
;
Hydrogen
;
Surface
;
Coverage
;
Work function
;
Magnetism
;
Heat of adsorption
Source:
Springer Online Journal Archives 1860-2000
Topics:
Chemistry and Pharmacology
Notes:
Abstract The MINDO/SR method is used to study surface properties such as the work function, heat of adsorption and magnetic moment as a function of hydrogen coverage. A good correlation between theory and experiment is found. Furthermore, a qualitative analysis of surface geometry changes due to hydrogen chemisorption is presented.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1007/BF00528323
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