{"title":"Critical Evaluation and Thermodynamic CALPHAD Reassessment of the Gallium–Germanium Binary System","authors":"Mohamed Idbenali","doi":"10.1134/S0036024424701656","DOIUrl":null,"url":null,"abstract":"<p>Thermodynamic modeling of the Ga–Ge binary system was carried out with the help of the CALPHAD (CALculation of PHAse Diagram) method. The liquid and diamond (Ge) phases have been described with the sublattice formalism and the excess model with the Redlich–Kister equation. The solution phase (Ga) was treated as a pure element. The most experimental data, including phase diagrams and thermodynamic information, gathered from the literature were employed to optimize the thermodynamic parameters. The resultant calculated phase diagram and the system’s thermodynamic properties are in satisfactory accordance with the majority of the experimental data.</p>","PeriodicalId":767,"journal":{"name":"Russian Journal of Physical Chemistry A","volume":"98 11","pages":"2479 - 2485"},"PeriodicalIF":0.7000,"publicationDate":"2024-10-28","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/S0036024424701656","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
Thermodynamic modeling of the Ga–Ge binary system was carried out with the help of the CALPHAD (CALculation of PHAse Diagram) method. The liquid and diamond (Ge) phases have been described with the sublattice formalism and the excess model with the Redlich–Kister equation. The solution phase (Ga) was treated as a pure element. The most experimental data, including phase diagrams and thermodynamic information, gathered from the literature were employed to optimize the thermodynamic parameters. The resultant calculated phase diagram and the system’s thermodynamic properties are in satisfactory accordance with the majority of the experimental data.
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.