KROUPA, Aleš, Vít VYKOUKAL, Tomáš KÁŇA, Adéla ZEMANOVÁ, Jiří PINKAS and Mojmír ŠOB. The theoretical and experimental study of the Sb-Sn nano-alloys. CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY. Oxford: PERGAMON-ELSEVIER SCIENCE, 2019, vol. 64, No 1, p. 90-96. ISSN 0364-5916. Available from: https://dx.doi.org/10.1016/j.calphad.2018.11.004.
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Basic information
Original name The theoretical and experimental study of the Sb-Sn nano-alloys
Authors KROUPA, Aleš (203 Czech Republic, guarantor), Vít VYKOUKAL (203 Czech Republic, belonging to the institution), Tomáš KÁŇA (203 Czech Republic), Adéla ZEMANOVÁ (203 Czech Republic), Jiří PINKAS (203 Czech Republic, belonging to the institution) and Mojmír ŠOB (203 Czech Republic, belonging to the institution).
Edition CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY, Oxford, PERGAMON-ELSEVIER SCIENCE, 2019, 0364-5916.
Other information
Original language English
Type of outcome Article in a journal
Field of Study 10402 Inorganic and nuclear chemistry
Country of publisher United Kingdom of Great Britain and Northern Ireland
Confidentiality degree is not subject to a state or trade secret
WWW URL
Impact factor Impact factor: 1.947
RIV identification code RIV/00216224:14310/19:00107551
Organization unit Faculty of Science
Doi http://dx.doi.org/10.1016/j.calphad.2018.11.004
UT WoS 000460842600010
Keywords in English PHASE-DIAGRAM PREDICTION; AB-INITIO; SOFTWARE; COMPLEX; SYSTEM
Tags CF CRYO
Tags International impact, Reviewed
Changed by Changed by: Mgr. Pavla Foltynová, Ph.D., učo 106624. Changed: 4/3/2020 14:39.
Abstract
The Sb-Sn nano-alloys were prepared by wet synthesis and studied experimentally and by theoretical modelling. A combination of CALPHAD and ab initio method for modelling of the influence of particle size on the thermodynamic properties and phase equilibria in systems with complex, intermetallic phases was used to model the properties of the Sb-Sn system. The disappearance of the Sb2Sn3 phase was predicted for the equilibria with the particle radius below 80 nm. The experimental study carried out on Sb-Sn nanoalloys showed that Sb2Sn3 did not appear during the 1st run of DSC measurement, when the morphology of sample contains agglomerates of nanoparticles with the radius below 50 nm.
Links
GA17-15405S, research and development projectName: Pokročilé experimentální a teoretické přístupy k fázovým diagramům nanoslitin se zahrnutím vlivu velikosti částic
Investor: Czech Science Foundation
LM2015043, research and development projectName: Česká infrastruktura pro integrativní strukturní biologii (Acronym: CIISB)
Investor: Ministry of Education, Youth and Sports of the CR
LQ1601, research and development projectName: CEITEC 2020 (Acronym: CEITEC2020)
Investor: Ministry of Education, Youth and Sports of the CR
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