Dataset Information

Observation of ?-Al₄₁Sm₅ reveals motif-aware structural evolution in Al-Sm alloys.

ABSTRACT: Using an effective genetic algorithm, we uncover the structure of a metastable Al₄₁Sm₅ phase that supplements its family sharing similar short-range orders. The phase evolves upon heating an amorphous Al-9.7?at.% Sm ribbon, produced by melt-spinning. The dynamical phase selection is discussed with respect to the structural connections between the short-range packing motifs in the amorphous precursor and those observed in the selected phases. The phase elucidated here is one of several newly discovered large-unit-cell phases found to form during devitrification from the glass in this binary system, further illustrating the power and efficiency of our approach, the important role of structural hierarchy in phase selection, and the richness of the metastable phase landscape accessible from the glassy structure.

SUBMITTER: Ye Z

PROVIDER: S-EPMC6491476 | biostudies-literature | 2019 Apr

REPOSITORIES: biostudies-literature

ACCESS DATA

Publications

Observation of η-Al41Sm5 reveals motif-aware structural evolution in Al-Sm alloys.

Ye Z Z Meng F F Zhang F F Sun Y Y Yang L L Zhou S H SH Napolitano R E RE Mendelev M I MI Ott R T RT Kramer M J MJ Wang C Z CZ Ho K M KM

Scientific reports 20190430 1

Using an effective genetic algorithm, we uncover the structure of a metastable Al41Sm5 phase that supplements its family sharing similar short-range orders. The phase evolves upon heating an amorphous Al-9.7 at.% Sm ribbon, produced by melt-spinning. The dynamical phase selection is discussed with respect to the structural connections between the short-range packing motifs in the amorphous precursor and those observed in the selected phases. The phase elucidated here is one ...[more]

PMID: 31040308

Similar Datasets

Project description:The spontaneous crystal surface reconstruction of M-plane α-Al2O3 is employed for nanopatterning and nanofabrication in various fields of research including, among others, magnetism, superconductivity, and optoelectronics. In this reconstruction process the crystalline surface transforms from a planar morphology to one with a nanoscale ripple patterning. However, the high sample temperature required to induce surface reconstruction made in situ studies of the process seem unfeasible. The kinetics of ripple pattern formation therefore remained uncertain, and thus production of templates for nanofabrication could not advance beyond a trial-and-error stage. We present an approach combining in situ real-time grazing incidence small-angle X-ray scattering experiments (GISAXS) with model-based analysis and with ex situ atomic force microscopy (AFM) to observe this morphological transition in great detail. Our approach provides time-resolved information about all relevant morphological parameters required to trace the surface topography on the nanometer scale during reconstruction, i.e., the time dependence of the pattern wavelength, the ripple length, width, and height, and thus their facet angles. It offers a comprehensive picture of this process exemplified by a M-plane α-Al2O3 surface annealed at 1325 °C for 930 min. Fitting the model parameters to the experimental GISAXS data revealed a Johnson-Mehl-Avrami-Kolmogorov type of behavior for the pattern wavelength and a predominantly linear time dependence of the other parameters. In this case the reconstruction resulted in a crystalline surface fully patterned with asymmetric ripple-shaped nanostructures of 75 nm periodicity, 15 nm in height, and 630 nm in length. By elucidating the time dependence of these morphological parameters, this study shows a powerful way to significantly advance the predictability of annealing outcome and thus to efficiently customize nanopatterned α-Al2O3 templates for improved nanofabrication routines.

Project description:Coating system(s) will be required for Nb-silicide based alloys. Alumina forming alloys that are chemically compatible with the Nb-silicide based alloy substrate could be components of such systems. The intermetallic alloys Nb1.45Si2.7Ti2.25Al3.25Hf0.35 (MG5) and Nb1.35Si2.3Ti2.3Al3.7Hf0.35 (MG6) were studied in the cast, heat treated and isothermally oxidised conditions at 800 and 1200 °C to find out if they are αAl₂O₃ scale formers. A (Al/Si)alloy versus Nb/(Ti + Hf)alloy map, which can be considered to be a map for Multi-Principle Element or Complex Concentrated Nb-Ti-Si-Al-Hf alloys, and a [Nb/(Ti + Hf)]Nb5Si3 versus [Nb/(Ti + Hf)]alloy map were constructed making use of the alloy design methodology NICE and data from a previously studied alloy, and were used to select the alloys MG5 and MG6 that were expected (i) not to pest, (ii) to form αAl₂O₃ scale at 1200 °C, (iii) to have no solid solution, (iv) to form only hexagonal Nb₅Si₃ and (v) to have microstructures consisting of hexagonal Nb₅Si₃, Ti₅Si₃, Ti₅Si₄, TiSi silicides, and tri-aluminides and Al rich TiAl. Both alloys met the requirements (i) to (v). The alumina scale was able to self-heal at 1200 °C. Liquation in the alloy MG6 at 1200 °C was linked with the formation of a eutectic like structure and the TiAl aluminide in the cast alloy. Key to the oxidation of the alloys was the formation (i) of "composite" silicide grains in which the Nb₅Si₃ core was surrounded by the Ti₅Si₄ and TiSi silicides, and (ii) of tri-aluminides with high Al/Si ratio, particularly at 1200 °C and very low Nb/Ti ratio forming in-between the "composite" silicide grains. Both alloys met the "standard definition" of high entropy alloys (HEAs). Compared with HEAs with bcc solid solution and intermetallics, the VEC values of both the alloys were outside the range of reported values. The parameters VEC,  and  of Nb-Ti-Si-Al-Hf coating alloys and non-pesting Nb-silicide based alloys were compared and trends were established. Selection of coating alloys with possible "layered" structures was discussed and alloy compositions were proposed.

Dataset Information

Observation of ?-Al₄₁Sm₅ reveals motif-aware structural evolution in Al-Sm alloys.

Publications

Observation of η-Al<sub>41</sub>Sm<sub>5</sub> reveals motif-aware structural evolution in Al-Sm alloys.

Similar Datasets

OmicsDI is part of the ELIXIR infrastructure

Dataset Information

Observation of ?-Al41Sm5 reveals motif-aware structural evolution in Al-Sm alloys.

Publications

Observation of η-Al<sub>41</sub>Sm<sub>5</sub> reveals motif-aware structural evolution in Al-Sm alloys.

Similar Datasets

OmicsDI is part of the ELIXIR infrastructure

Observation of ?-Al₄₁Sm₅ reveals motif-aware structural evolution in Al-Sm alloys.