| 1 |
Sm-Doped LaSi3N5: Synthesis, Computed Electronic Structure, and Band Gaps
Ibrahim IAM, Lences Z, Benco L, Hrabalova M, Sajgalik P
Journal of the American Ceramic Society, 97(8), 2546, 2014 |
| 2 |
Compensation effect. A DFT study of the activation of N2O over M-CHA (M = Fe2+, Co2+, RuO2+, RuO+)
Benco L
Journal of Catalysis, 298, 122, 2013 |
| 3 |
Dehydrogenation of propane over Zn-MOR. Static and dynamic reaction energy diagram
Benco L, Bucko T, Hafner J
Journal of Catalysis, 277(1), 104, 2011 |
| 4 |
Monomolecular cracking of propane over acidic chabazite: An ab initio molecular dynamics and transition path sampling study
Bucko T, Benco L, Hafner J, Angyan JG
Journal of Catalysis, 279(1), 220, 2011 |
| 5 |
Europium-Doped LaSi3N5 Ternary Nitride: Synthesis, Spectroscopy, Computed Electronic Structure and Band Gaps
Benco L, Lences Z, Sajgalik P, Jane E, Velic D
Journal of the American Ceramic Society, 94(12), 4345, 2011 |
| 6 |
N2O decomposition over Fe-zeolites: Structure of the active sites and the origin of the distinct reactivity of Fe-ferrierite, Fe-ZSM-5, and Fe-beta. A combined periodic DFT and multispectral study
Sklenak S, Andrikopoulos PC, Boekfa B, Jansang B, Novakova J, Benco L, Bucko T, Hafner J, Dedecek J, Sobalik Z
Journal of Catalysis, 272(2), 262, 2010 |
| 7 |
Proton exchange of small hydrocarbons over acidic chabazite: Ab initio study of entropic effects
Bucko T, Benco L, Hafner J, Angyan JG
Journal of Catalysis, 250(1), 171, 2007 |
| 8 |
Theoretical investigation of CO interaction with copper sites in zeolites: Periodic DFT and hybrid quantum mechanical/interatomic potential function study
Bludsky O, Silhan M, Nachtigall P, Bucko T, Benco L, Hafner J
Journal of Physical Chemistry B, 109(19), 9631, 2005 |
| 9 |
Periodic DFT calculations of the stability of Al/Si substitutions and extraframework Zn2+ cations in mordenite and reaction pathway for the dissociation of H-2 and CH4
Benco L, Bucko T, Hafner J, Toulhoat H
Journal of Physical Chemistry B, 109(43), 20361, 2005 |
| 10 |
A density functional theory study of molecular and dissociative adsorption of H-2 on active sites in mordenite
Benco L, Bucko T, Hafner J, Toulhoat H
Journal of Physical Chemistry B, 109(47), 22491, 2005 |
