ON PHASE DIAGRAM OF Au-Si NANOALLOY: MOLECULAR DYNAMICS AND THERMODYNAMIC SIMULATION

Autor:	I.V. Talyzin, A.Yu. Kartoshkin, S.A. Vasilyev, M.V. Samsonov, V.M. Samsonov
Jazyk:	ruština
Rok vydání:	2019
Předmět:	au-si nanoalloy phase diagram molecular dynamics thermodynamic simulation calphad Physical and theoretical chemistry QD450-801
Zdroj:	Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов, Iss 11, Pp 364-373 (2019)
Druh dokumentu:	article
ISSN:	2226-4442 2658-4360
DOI:	10.26456/pcascnn/2019.11.364
Popis:	Phase diagrams for Au-Si nanoparticles were constructed by using molecular dynamics and thermodynamic simulation, based on the CALPHAD methodology extended to nanoscale objects. It was established that the eutectic temperature of nanoparticles decreases by about 200 K compared to the bulk eutectic temperature, and the position of the eutectic point slightly shifts to a lower value of the molar fraction of Si.
Databáze:	Directory of Open Access Journals
Externí odkaz:	https://doaj.org/article/203522d904fe416a9a7bb326519f260a Zobrazit plný text záznamu View record in DOAJ