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Temperature and initial composition dependence of pattern formation and dynamic behavior in phase separation under deep-quenched conditions

Phase separation of SCN-H(2)O ([CH(2)CN](2)–H(2)O) transparent solutions is simulated in two dimensions and the effects of quenching temperature and initial composition on the pattern formation and dynamic behavior of the second phase are examined via Minkowski functionals. The simulation is based o...

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Autores principales: Zhang, Liang, Peng, Yinli, Zhang, Li, Lei, Xiaowei, Yao, Wenjing, Wang, Nan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9062494/
https://www.ncbi.nlm.nih.gov/pubmed/35515277
http://dx.doi.org/10.1039/c9ra01118h
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author Zhang, Liang
Peng, Yinli
Zhang, Li
Lei, Xiaowei
Yao, Wenjing
Wang, Nan
author_facet Zhang, Liang
Peng, Yinli
Zhang, Li
Lei, Xiaowei
Yao, Wenjing
Wang, Nan
author_sort Zhang, Liang
collection PubMed
description Phase separation of SCN-H(2)O ([CH(2)CN](2)–H(2)O) transparent solutions is simulated in two dimensions and the effects of quenching temperature and initial composition on the pattern formation and dynamic behavior of the second phase are examined via Minkowski functionals. The simulation is based on model H where the molar free energy of the SCN-H(2)O solution is obtained by the CALPHAD approach. We find that the composition and temperature do not affect the exponent in the domain growth law, where the average domain size with time yields R(t)–t(n). However, they influence the pattern formation and dynamic behavior of the second phase in phase separation. Lower temperature leads to a finer bicontinuous structure in spinodal decomposition and promotes the nucleation rate, which accelerates the phase separation and results in more liquid droplets with smaller size. As the initial composition diverges from the critical value, the spatial patterns change gradually from bicontinuous into a droplet-like structure. When the initial composition is closer to the critical value, for spinodal decomposition, the diffusion-driven growth lasts for a longer time and the average domain size of liquid droplets is larger. For nucleation-driven growth, in contrast, the single phase separates more quickly and the average size of liquid droplets is smaller.
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spelling pubmed-90624942022-05-04 Temperature and initial composition dependence of pattern formation and dynamic behavior in phase separation under deep-quenched conditions Zhang, Liang Peng, Yinli Zhang, Li Lei, Xiaowei Yao, Wenjing Wang, Nan RSC Adv Chemistry Phase separation of SCN-H(2)O ([CH(2)CN](2)–H(2)O) transparent solutions is simulated in two dimensions and the effects of quenching temperature and initial composition on the pattern formation and dynamic behavior of the second phase are examined via Minkowski functionals. The simulation is based on model H where the molar free energy of the SCN-H(2)O solution is obtained by the CALPHAD approach. We find that the composition and temperature do not affect the exponent in the domain growth law, where the average domain size with time yields R(t)–t(n). However, they influence the pattern formation and dynamic behavior of the second phase in phase separation. Lower temperature leads to a finer bicontinuous structure in spinodal decomposition and promotes the nucleation rate, which accelerates the phase separation and results in more liquid droplets with smaller size. As the initial composition diverges from the critical value, the spatial patterns change gradually from bicontinuous into a droplet-like structure. When the initial composition is closer to the critical value, for spinodal decomposition, the diffusion-driven growth lasts for a longer time and the average domain size of liquid droplets is larger. For nucleation-driven growth, in contrast, the single phase separates more quickly and the average size of liquid droplets is smaller. The Royal Society of Chemistry 2019-04-05 /pmc/articles/PMC9062494/ /pubmed/35515277 http://dx.doi.org/10.1039/c9ra01118h Text en This journal is © The Royal Society of Chemistry https://creativecommons.org/licenses/by-nc/3.0/
spellingShingle Chemistry
Zhang, Liang
Peng, Yinli
Zhang, Li
Lei, Xiaowei
Yao, Wenjing
Wang, Nan
Temperature and initial composition dependence of pattern formation and dynamic behavior in phase separation under deep-quenched conditions
title Temperature and initial composition dependence of pattern formation and dynamic behavior in phase separation under deep-quenched conditions
title_full Temperature and initial composition dependence of pattern formation and dynamic behavior in phase separation under deep-quenched conditions
title_fullStr Temperature and initial composition dependence of pattern formation and dynamic behavior in phase separation under deep-quenched conditions
title_full_unstemmed Temperature and initial composition dependence of pattern formation and dynamic behavior in phase separation under deep-quenched conditions
title_short Temperature and initial composition dependence of pattern formation and dynamic behavior in phase separation under deep-quenched conditions
title_sort temperature and initial composition dependence of pattern formation and dynamic behavior in phase separation under deep-quenched conditions
topic Chemistry
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9062494/
https://www.ncbi.nlm.nih.gov/pubmed/35515277
http://dx.doi.org/10.1039/c9ra01118h
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