{"title":"Theoretical Evaluation of Second Virial Coefficient over Yukawa Potential","authors":"Elif Somuncu, Bahtiyar A. Mamedov","doi":"10.1134/S0036024424702522","DOIUrl":null,"url":null,"abstract":"<p>In this paper, a new simple, and the easy analytical formula is proposed to calculate the second virial coefficient with Yukawa potential. As it is known, the suggested analytical formula can be used to investigate some thermodynamic properties and predictors for protein crystallization and intermolecular interaction potential of fluids. The formula is tested for gas-liquid critical points and Hard-core Yukawa potential with different interaction ranges. The calculation results have been compared with different methods in literature data and the results agree with the literature data. Note that the second virial coefficient can provide significant results in the evaluated protein crystallization and investigate the gas-liquid separation with critical temperature.</p>","PeriodicalId":767,"journal":{"name":"Russian Journal of Physical Chemistry A","volume":"98 13","pages":"3001 - 3008"},"PeriodicalIF":0.7000,"publicationDate":"2025-01-17","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Russian Journal of Physical Chemistry A","FirstCategoryId":"92","ListUrlMain":"https://link.springer.com/article/10.1134/S0036024424702522","RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
引用次数: 0
Abstract
In this paper, a new simple, and the easy analytical formula is proposed to calculate the second virial coefficient with Yukawa potential. As it is known, the suggested analytical formula can be used to investigate some thermodynamic properties and predictors for protein crystallization and intermolecular interaction potential of fluids. The formula is tested for gas-liquid critical points and Hard-core Yukawa potential with different interaction ranges. The calculation results have been compared with different methods in literature data and the results agree with the literature data. Note that the second virial coefficient can provide significant results in the evaluated protein crystallization and investigate the gas-liquid separation with critical temperature.
期刊介绍：
Russian Journal of Physical Chemistry A. Focus on Chemistry (Zhurnal Fizicheskoi Khimii), founded in 1930, offers a comprehensive review of theoretical and experimental research from the Russian Academy of Sciences, leading research and academic centers from Russia and from all over the world.
Articles are devoted to chemical thermodynamics and thermochemistry, biophysical chemistry, photochemistry and magnetochemistry, materials structure, quantum chemistry, physical chemistry of nanomaterials and solutions, surface phenomena and adsorption, and methods and techniques of physicochemical studies.
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