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Inorganic chemistry, 01/2020, Volume 59, Issue 1, p. 360
A new ternary phase with a composition Al V Sn ( = 0.19) has been found during investigation of the Al-V-Sn ternary system. Single-crystal X-ray diffraction... 
Journal Article
The Journal of Physical Chemistry C, ISSN 1932-7447, 08/2017, Volume 121, Issue 34, pp. 18738 - 18745
Density functional theory calculations are used to investigate the catalytic properties of the o-Al13Co4(100) surface toward the semihydrogenation of... 
CHEMISORPTION | MATERIALS SCIENCE, MULTIDISCIPLINARY | ENERGETICS | CHEMISTRY, PHYSICAL | NANOSCIENCE & NANOTECHNOLOGY | ADSORPTION | ALUMINUM | SELECTIVE HYDROGENATION | DISSOCIATION | KINETICS | PARTICLE-SIZE | ALLOY | PALLADIUM CATALYSTS | Engineering Sciences | Micro and nanotechnologies | Microelectronics
Journal Article
The Journal of Physical Chemistry C, ISSN 1932-7447, 03/2017, Volume 121, Issue 9, pp. 4958 - 4969
Journal Article
The Journal of Physical Chemistry C, ISSN 1932-7447, 10/2014, Volume 118, Issue 40, pp. 23032 - 23041
This paper presents the adsorption properties of the o-Al13Co4(100) surface toward molecules involved in the semihydrogenation of acetylene. The energetically... 
PALLADIUM | CHEMISORPTION | HYDROCARBONS | MATERIALS SCIENCE, MULTIDISCIPLINARY | DECOMPOSITION | CHEMISTRY, PHYSICAL | NANOSCIENCE & NANOTECHNOLOGY | VIBRATIONAL-SPECTRA | TRANSITION | SELECTIVE HYDROGENATION | ETHYLENE | METAL | CATALYSTS | Condensed Matter | Materials Science | Material chemistry | Physics | Chemical Sciences
Journal Article
The Journal of Physical Chemistry C, ISSN 1932-7447, 12/2018, Volume 122, Issue 51, pp. 29298 - 29306
Designing surfaces with specific atomic and electronic structures is a main goal in nanoscience. One possible approach is based on complex intermetallic... 
FILMS | MATERIALS SCIENCE, MULTIDISCIPLINARY | ALGORITHM | CHEMISTRY, PHYSICAL | NANOSCIENCE & NANOTECHNOLOGY | TOTAL-ENERGY CALCULATIONS | QUASI-CRYSTAL | CORROSION | CATALYST | ADSORPTION | INITIO MOLECULAR-DYNAMICS
Journal Article
JOURNAL OF PHYSICAL CHEMISTRY C, ISSN 1932-7447, 05/2019, Volume 123, Issue 19, pp. 12355 - 12366
Intermetallic cage compounds have crystal structures characterized by three-dimensional (3D) frameworks of host atoms forming cages that may be filled with... 
PALLADIUM | MATERIALS SCIENCE, MULTIDISCIPLINARY | ALGORITHM | CHEMISTRY, PHYSICAL | NANOSCIENCE & NANOTECHNOLOGY | TOTAL-ENERGY CALCULATIONS | INITIO MOLECULAR-DYNAMICS | ELECTRON LOCALIZATION | SPECIAL-ISSUE | Condensed Matter | Materials Science | Material chemistry | Physics | Chemical Sciences
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 08/2015, Volume 143, Issue 7, p. 074705
Journal Article
Materials and Design, ISSN 0264-1275, 03/2012, Volume 35, pp. 691 - 695
[Display omitted] ► Quasicrystal–polymer composite was adapted for selective laser sintering (SLS). ► SLS processed parts show reduced friction and improved... 
ALLOYS | MATERIALS SCIENCE, MULTIDISCIPLINARY | STRENGTH | Sintering | Composite materials industry
Journal Article
Journal Article
Journal Article
Physical Review B - Condensed Matter and Materials Physics, ISSN 1098-0121, 11/2012, Volume 86, Issue 20
We have used scanning tunneling microscopy (STM), low-energy electron diffraction (LEED), and density functional theory (DFT) to elucidate the structure and... 
SURFACE | PHYSICS, CONDENSED MATTER
Journal Article
Physical Review B - Condensed Matter and Materials Physics, ISSN 1098-0121, 02/2014, Volume 89, Issue 8
C-60 monolayers grown on Ag(111) at room temperature form incommensurate lattices that convert into a commensurate (2 root 3 x 2 root 3)R30 degrees phase upon... 
FULLERENES | PHYSICS, CONDENSED MATTER | SCANNING-TUNNELING-MICROSCOPY | SURFACES
Journal Article
PHYSICAL REVIEW B, ISSN 1098-0121, 12/2012, Volume 86, Issue 21
The growth and stability of Bi thin films on the Al13Co4(100) surface has been investigated from the submonolayer to high-coverage regime by scanning tunneling... 
AUGMENTED-WAVE METHOD | PHYSICS, CONDENSED MATTER | TOTAL-ENERGY CALCULATIONS | BISMUTH | FILMS | BASIS-SET
Journal Article
Physical Review B - Condensed Matter and Materials Physics, ISSN 1098-0121, 08/2011, Volume 84, Issue 8
In a combined scanning tunneling microscopy (STM), low-energy electron diffraction (LEED), and density functional theory (DFT) study of the surface of... 
AUGMENTED-WAVE METHOD | PHYSICS, CONDENSED MATTER | METALS | TOTAL-ENERGY CALCULATIONS | CRYSTAL | BASIS-SET | CO4AL13
Journal Article
Physical Review B - Condensed Matter and Materials Physics, ISSN 1098-0121, 08/2010, Volume 82, Issue 8
Lead is one of few elements that adopts a pseudomorphic structure when deposited on quasicrystalline substrates. We present a structural model of quasiperiodic... 
PHASES | PHYSICS, CONDENSED MATTER | LIQUID POLYVALENT ELEMENTS | METALS | ALLOYS | TOTAL-ENERGY CALCULATIONS | NUCLEATION | CRYSTALLINE | WAVE BASIS-SET | LEAD
Journal Article
Physical Review B - Condensed Matter and Materials Physics, ISSN 1098-0121, 02/2015, Volume 91, Issue 8
The Al5Co2 crystal is a complex intermetallic compound, whose structure can be described by a stacking of chemically bonded atomic motifs. It is a potentially... 
AUGMENTED-WAVE METHOD | PHYSICS, CONDENSED MATTER | SCANNING TUNNELING MICROSCOPE | CRYSTAL-STRUCTURE | CHEMICAL-POTENTIALS | AL-CO | TOTAL-ENERGY CALCULATIONS | PHASE-EQUILIBRIA | TRANSITION-METAL ALUMINIDES | INITIO MOLECULAR-DYNAMICS | ELECTRONIC-STRUCTURE
Journal Article
Journal of Physics D: Applied Physics, ISSN 0022-3727, 03/2005, Volume 38, Issue 6, pp. R83 - R106
An overview is given of the research conducted in the field of solid film growth on quasiperiodic surfaces. An atomistic description of quasicrystalline... 
THIN-FILMS | FIVEFOLD SURFACE | ENERGY | PHYSICS, APPLIED | TEMPERATURE | DIFFRACTION | RELAXATION | FABRICATION | NUCLEATION | ISLAND-SIZE | ALPDMN
Journal Article
Applied Surface Science, ISSN 0169-4332, 12/2015, Volume 357, pp. 1666 - 1675
•Oxidation mechanisms on Al9Co2(001) and Al13Co4(100) CMA surfaces.•Oxidation kinetics dependent on oxygen partial pressure; no aluminium segregation.•Lack of... 
C2Hn adsorption | XPS | Al–Co complex metallic alloys | LEED | Initial oxidation | adsorption | Al-Co complex metallic alloys
Journal Article
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