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FRIÁK, M. ČÍPEK, P. PAVLŮ, J. ZOBAČ, O. ROUPCOVÁ, P. MIHÁLIKOVÁ, I. HOLEC, D. MSALLAMOVÁ, Š. MICHALCOVÁ, A.
Originální název
Structure-Property Relations in Pb-Supersaturated Metastable Sn-Rich Pb-Sn Alloys
Typ
článek v časopise ve Web of Science, Jimp
Jazyk
angličtina
Originální abstrakt
We have performed a theoretical study of three polymorphs of Pb-supersaturated Sn-rich Pb-Sn alloys with the -Sn, -Sn, and a simple-hexagonal -Sn structure employing quantum-mechanical calculations. We focused on structure–property relations in the case of lattice parameters, thermodynamic stability, elastic properties, and mechanical stability as well as electronic-structure density of states. Compositional trends in structural, thermodynamic, and electronic properties were found nearly linear. Our study also sheds new light on a decades-long controversy surrounding the existence of -phase and -phase supersaturated Sn-rich Pb-Sn alloys. We suggest that the experimental difficulties when synthesizing them are caused by their high formation energy and mechanical instability of the -phase.
Klíčová slova
TIN; CRYSTAL
Autoři
FRIÁK, M.; ČÍPEK, P.; PAVLŮ, J.; ZOBAČ, O.; ROUPCOVÁ, P.; MIHÁLIKOVÁ, I.; HOLEC, D.; MSALLAMOVÁ, Š.; MICHALCOVÁ, A.
Vydáno
1. 6. 2024
Nakladatel
SPRINGER
Místo
NEW YORK
ISSN
1543-1940
Periodikum
Metallurgical and Materials Transactions A: Physical Metallurgy and Materials Science
Ročník
55
Číslo
6
Stát
Spojené státy americké
Strany od
1867
Strany do
1877
Strany počet
11
URL
https://link.springer.com/article/10.1007/s11661-024-07362-3
BibTex
@article{BUT188820, author="Martin {Friák} and Petr {Čípek} and Jana {Pavlů} and Ondřej {Zobač} and Pavla {Roupcová} and Ivana {Miháliková} and David {Holec} and Šárka {Msallamová} and Alena {Michalcová}", title="Structure-Property Relations in Pb-Supersaturated Metastable Sn-Rich Pb-Sn Alloys", journal="Metallurgical and Materials Transactions A: Physical Metallurgy and Materials Science", year="2024", volume="55", number="6", pages="1867--1877", doi="10.1007/s11661-024-07362-3", issn="1543-1940", url="https://link.springer.com/article/10.1007/s11661-024-07362-3" }