Structure-Property Relations in Pb-Supersaturated Metastable
Sn-Rich Pb-Sn Alloys

J 2024

Structure-Property Relations in Pb-Supersaturated Metastable Sn-Rich Pb-Sn Alloys

FRIAK, M., Petr ČÍPEK, Jana PAVLŮ, O. ZOBAČ, P. ROUPCOVÁ et. al.

Basic information

Original name

Structure-Property Relations in Pb-Supersaturated Metastable Sn-Rich Pb-Sn Alloys

Authors

FRIAK, M., Petr ČÍPEK (203 Czech Republic, belonging to the institution), Jana PAVLŮ (203 Czech Republic, guarantor, belonging to the institution), O. ZOBAČ, P. ROUPCOVÁ, I. MIHALIKOVÁ, D. HOLEC, S. MSALLAMOVÁ and A. MICHALCOVÁ

Edition

METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE, NEW YORK, SPRINGER, 2024, 1073-5623

Other information

Language

English

Type of outcome

Článek v odborném periodiku

Field of Study

10403 Physical chemistry

Country of publisher

United States of America

Confidentiality degree

není předmětem státního či obchodního tajemství

References:

URL

Impact factor

Impact factor: 2.800 in 2022

Organization unit

Faculty of Science

DOI

http://dx.doi.org/10.1007/s11661-024-07362-3

UT WoS

001197100200002

Keywords in English

TINCRYSTAL

Abstract

V originále

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.

Links

MUNI/A/1575/2023, interní kód MU

Name: Metody chemické a fyzikálně-chemické analýzy pro studium přírodních a syntetických materiálů.

Investor: Masaryk University, Methods of chemical and physico-chemical analysis for the study of natural and synthetic materials.

90254, large research infrastructures

Name: e-INFRA CZ II

Citovat

FRIAK, M., Petr ČÍPEK, Jana PAVLŮ, O. ZOBAČ, P. ROUPCOVÁ, I. MIHALIKOVÁ, D. HOLEC, S. MSALLAMOVÁ and A. MICHALCOVÁ. Structure-Property Relations in Pb-Supersaturated Metastable Sn-Rich Pb-Sn Alloys. METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE. NEW YORK: SPRINGER, 2024, vol. 55, No 6, p. 1867-1877. ISSN 1073-5623. Available from: https://dx.doi.org/10.1007/s11661-024-07362-3.

@article{2436078,
   author = {Friak, M. and Čípek, Petr and Pavlů, Jana and Zobač, O. and Roupcová, P. and Mihaliková, I. and Holec, D. and Msallamová, S. and Michalcová, A.},
   article_location = {NEW YORK},
   article_number = {6},
   doi = {http://dx.doi.org/10.1007/s11661-024-07362-3},
   keywords = {TINCRYSTAL},
   language = {eng},
   issn = {1073-5623},
   journal = {METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE},
   title = {Structure-Property Relations in Pb-Supersaturated Metastable Sn-Rich Pb-Sn Alloys},
   url = {https://link.springer.com/article/10.1007/s11661-024-07362-3},
   volume = {55},
   year = {2024}
}

TY  - JOUR
ID  - 2436078
AU  - Friak, M. - Čípek, Petr - Pavlů, Jana - Zobač, O. - Roupcová, P. - Mihaliková, I. - Holec, D. - Msallamová, S. - Michalcová, A.
PY  - 2024
TI  - Structure-Property Relations in Pb-Supersaturated Metastable Sn-Rich Pb-Sn Alloys
JF  - METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE
VL  - 55
IS  - 6
SP  - 1867-1877
EP  - 1867-1877
PB  - SPRINGER
SN  - 10735623
KW  - TINCRYSTAL
UR  - https://link.springer.com/article/10.1007/s11661-024-07362-3
N2  - 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.
ER  -

FRIAK, M., Petr ČÍPEK, Jana PAVLŮ, O. ZOBAČ, P. ROUPCOVÁ, I. MIHALIKOVÁ, D. HOLEC, S. MSALLAMOVÁ and A. MICHALCOVÁ. Structure-Property Relations in Pb-Supersaturated Metastable Sn-Rich Pb-Sn Alloys. \textit{METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE}. NEW YORK: SPRINGER, 2024, vol.~55, No~6, p.~1867-1877. ISSN~1073-5623. Available from: https://dx.doi.org/10.1007/s11661-024-07362-3.

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