COBISS Co-operative Online Bibliographic system & services COBISS
PhD Anton Kokalj [16188]
Representative bibliographic units
ARTICLES AND OTHER COMPONENT PARTS
1.01 Original scientific article
1.
KOKALJ, Anton, GAVA, Paola, GIRONCOLI, Stefano de, BARONI, Stefano. What determines
the catalyst's selectivity in the ethylene epoxidation reaction.
Journal of catalysis. 2008, vol. 254, no. 2, str. 304-309. ISSN 0021-9517.
http://dx.doi.org/10.1016/j.jcat.2008.01.008. [COBISS.SI-ID
21489447]
2.
KOKALJ, Anton, DOMINKO, Robert, MALI, Gregor, MEDEN, Anton, GABERŠČEK, Miran, JAMNIK,
Janko. Beyond one-electron reaction in Li cathode materials : designing ▫$Li_2Mn_xFe_{1-x}SiO_4$▫.
Chemistry of materials. [Print ed.]. 2007, vol. 19, no. 15, str. 3633-3640. ISSN 0897-4756. [COBISS.SI-ID
3734554]
3.
KOKALJ, Anton, BONINI, Nicola, GIRONCOLI, Stefano de, SBRACCIA, Carlo, FRATESI, Guido,
BARONI, Stefano. Methane dehydrogenation on Rh@Cu(111) : a first-principles study
of a model catalyst.
Journal of the American Chemical Society : JACS. 2006, vol. 128, str. 12448-12454. ISSN 0002-7863. [COBISS.SI-ID
20356391]
4.
KOKALJ, Anton, MATSUSHIMA, Tatsuo. A density-functional theory study of the interaction
of ▫$N_2O$▫ with Rh(110).
The Journal of chemical physics. 2005, vol. 122, str. 034708-1-034708-10. ISSN 0021-9606. [COBISS.SI-ID
18700583]
5.
KOKALJ, Anton, BONINI, Nicola, SBRACCIA, Carlo, GIRONCOLI, Stefano de, BARONI, Stefano.
Engineering the reactivity of metal catalysts : a model study of methane dehydrogenation
on Rh(111).
Journal of the American Chemical Society : JACS. 2004, vol. 126, str. 16732-16733. ISSN 0002-7863. [COBISS.SI-ID
18694695]
6.
KOKALJ, Anton, KOBAL, Ivan, MATSUSHIMA, Tatsuo. A DFT study of the structures of ▫$N_2O$▫ adsorbed on the Pd(110) surface.
The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces
& biophysical. 2003, vol. 107, str. 2741-2747. ISSN 1520-6106. [COBISS.SI-ID
17427239]
7.
KOKALJ, Anton, DAL CORSO, A., GIRONCOLI, S. de, BARONI, S. The interaction of ethylene
with perfect and defective Ag(001) surfaces.
The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces
& biophysical. 2002, vol. 106, str. 9839-9846. ISSN 1520-6106. [COBISS.SI-ID
17144359]
8.
KOKALJ, Anton. XCrySDen - a new program for displaying crystalline structures and
electron densities.
Journal of Molecular Graphics & Modelling. [Print ed.]. 1999, vol. 17, str. 176-179. ISSN 1093-3263. [COBISS.SI-ID
14935335]
1.06 Published scientific conference contribution (invited lecture)
9.
KOKALJ, Anton. An ab initio study of adsorption and dissociation of ▫$N_2$▫ on Rh(110) and Pd(110). In:
The 15th CRC International Symposium on "Catalytic Reaction Dynamics and Surface Nano-Structures"
: Oct. 27-29,2004, Hokkaido, University, Sapporo, Japan. [S.l.: s.n.], 2004. Str. 122-128. [COBISS.SI-ID
18698535]
1.12 Published scientific conference contribution abstract
10.
KOKALJ, Anton. Computer-aided design of the reaction site : a model study of methane
dehydrogenation on Rh@Cu(111) : [invited talk]. In:
Book of abstracts, program, list of participants. Third Humboldt Conference on Computational Chemistry, Varna, Bulgaria, 24-28, 2006.
[S. l.: s. n.], 2006. Str. 21. ISBN 954-323-199-0, ISBN 978-954-323-199-7. [COBISS.SI-ID
20357927]
Selected format of bibliographic unit: ISO 690
Sorting of bibliographic units: Typology, year - descending, title
A source of bibliographic data: shared data base COBISS.SI/COBIB.SI, 29. 2. 2024