N. Atamas, D. Gavryushenko, G. Taranyk, V. Kashchenko
{"title":"Clustering in Water-Propanol Solutions","authors":"N. Atamas, D. Gavryushenko, G. Taranyk, V. Kashchenko","doi":"10.1109/NAP51885.2021.9568589","DOIUrl":null,"url":null,"abstract":"The correct method for the determination of the structure of water-alcohol solution at different concentration by using Monte Carlo (MC) simulation ware developed and was used to study of aqueous solution of propanol. It was found that at the concentrations lower than $X_{pr} \\sim 0.04$ mole propanol molecules do not influence on the physical-chemical properties of water in water-propanol solution; at the concentration $X_{pr} \\sim 0.2$ mole the fluctuations in the form of the clusters of propanol molecules at concentration was determined; at the concentration range $X_{pr} \\sim (0.3-0.38)$ mole propanol molecules form the micelles.","PeriodicalId":6735,"journal":{"name":"2021 IEEE 11th International Conference Nanomaterials: Applications & Properties (NAP)","volume":"22 1","pages":"1-5"},"PeriodicalIF":0.0000,"publicationDate":"2021-09-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"2021 IEEE 11th International Conference Nanomaterials: Applications & Properties (NAP)","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1109/NAP51885.2021.9568589","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0
Abstract
The correct method for the determination of the structure of water-alcohol solution at different concentration by using Monte Carlo (MC) simulation ware developed and was used to study of aqueous solution of propanol. It was found that at the concentrations lower than $X_{pr} \sim 0.04$ mole propanol molecules do not influence on the physical-chemical properties of water in water-propanol solution; at the concentration $X_{pr} \sim 0.2$ mole the fluctuations in the form of the clusters of propanol molecules at concentration was determined; at the concentration range $X_{pr} \sim (0.3-0.38)$ mole propanol molecules form the micelles.
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