Shear deformation, ideal strength, and stacking fault formation of fcc metals: A density-functional study of Al and Cu M Jahnátek, J Hafner, M Krajčí Physical Review B 79 (22), 224103, 2009 | 168 | 2009 |
Atomic and electronic structure of icosahedral Al-Pd-Mn alloys and approximant phases M Krajčí, M Windisch, J Hafner, G Kresse, M Mihalkovič Physical Review B 51 (24), 17355, 1995 | 158 | 1995 |
Electronic structure and stability of quasicrystals: Quasiperiodic dispersion relations and pseudogaps J Hafner, M Krajčí Physical review letters 68 (15), 2321, 1992 | 154 | 1992 |
Electronic structure of quasicrystalline Al-Zn-Mg alloys and related crystalline, amorphous, and liquid phases J Hafner, M Krajci Physical Review B 47 (18), 11795, 1993 | 96 | 1993 |
Interatomic bonding, elastic properties, and ideal strength of transition metal aluminides: A case study for Al 3 (V, Ti) M Jahnátek, M Krajčí, J Hafner Physical Review B 71 (2), 024101, 2005 | 89 | 2005 |
Formation of magnetic moments in crystalline, quasicrystalline, and liquid Al-Mn alloys J Hafner, M Krajčí Physical Review B 57 (5), 2849, 1998 | 74 | 1998 |
Propagating and confined vibrational excitations in quasicrystals J Hafner, M Krajci Journal of Physics: Condensed Matter 5 (16), 2489, 1993 | 73 | 1993 |
Complex intermetallic compounds as selective hydrogenation catalysts–A case study for the (1 0 0) surface of Al13Co4 M Krajčí, J Hafner Journal of catalysis 278 (2), 200-207, 2011 | 69 | 2011 |
Structure, stability, and electronic properties of the -AlPdMn quasicrystalline surface M Krajčí, J Hafner Physical Review B 71 (5), 054202, 2005 | 69 | 2005 |
Covalent bonding and bandgap formation in transition-metal aluminides: di-aluminides of group VIII transition metals M Krajci, J Hafner Journal of Physics: Condensed Matter 14 (23), 5755, 2002 | 67 | 2002 |
Propagating and localized vibrational modes in Ni-Zr glasses J Hafner, M Krajci Journal of Physics: Condensed Matter 6 (25), 4631, 1994 | 67 | 1994 |
Surface vacancies at the fivefold icosahedral Al-Pd-Mn quasicrystal surface: A comparison of ab initio calculated and experimental STM images M Krajčí, J Hafner, J Ledieu, R McGrath Physical Review B 73 (2), 024202, 2006 | 64 | 2006 |
Intermetallic compounds as selective heterogeneous catalysts: insights from DFT M Krajčí, J Hafner ChemCatChem 8 (1), 34-48, 2016 | 57 | 2016 |
Atomic and electronic structure of decagonal Al-Pd-Mn alloys and approximant phases M Krajci, J Hafner, M Mihalkovic Physical Review B 55 (2), 843, 1997 | 54 | 1997 |
Electronic structure and transport properties of decagonal Al-Cu-Co alloys M Krajčí, J Hafner, M Mihalkovič Physical Review B 56 (6), 3072, 1997 | 52 | 1997 |
Intermetallic compound AlPd as a selective hydrogenation catalyst: a DFT study M Krajci, J Hafner The Journal of Physical Chemistry C 116 (10), 6307-6319, 2012 | 50 | 2012 |
Ab initio study of quasiperiodic monolayers on a fivefold surface M Krajčí, J Hafner Physical Review B 71 (18), 184207, 2005 | 50 | 2005 |
Atomic and electronic structure of decagonal Al-Ni-Co alloys and approximant phases M Krajčí, J Hafner, M Mihalkovič Physical Review B 62 (1), 243, 2000 | 50 | 2000 |
Nucleation of Pb starfish clusters on the five-fold Al-Pd-Mn quasicrystal surface J Ledieu, M Krajčí, J Hafner, L Leung, LH Wearing, R McGrath, ... Physical Review B 79 (16), 165430, 2009 | 49 | 2009 |
Covalent bonding and bandgap formation in intermetallic compounds: a case study for Al3V M Krajci, J Hafner Journal of Physics: Condensed Matter 14 (8), 1865, 2002 | 49 | 2002 |