{"title":"用分子相互作用体积模型计算Sn- au - cu三元液态合金混合过程中Sn活度和整体多余自由能变化","authors":"Sanjay Kumar Sah, Ishwar Koirala","doi":"10.1088/2399-6528/ad035a","DOIUrl":null,"url":null,"abstract":"Abstract The activities of Sn in the liquid solder ternary alloy Sn-Au-Cu at 900 K have been computed using the molecular interaction volume model (MIVM). The calculated values have been compared with the experimental data for three cross-sections, i.e., for three different ratios of aurum to copper (XAu:XCu) = 3:1, 1:1, and 1:3. In addition, the excess Gibbs free energy of mixing, ΔGEx, for these ternary liquid alloys has been determined using the same model parameters to assess their validity. The resulting values have then been compared with the corresponding experimental data found in the literature. The agreement between the theoretical and experimental results has been found to be satisfactory.","PeriodicalId":47089,"journal":{"name":"Journal of Physics Communications","volume":null,"pages":null},"PeriodicalIF":1.1000,"publicationDate":"2023-10-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Computational assessment of Sn activities and integral excess free energy change for mixing in the Sn-Au-Cu ternary liquid alloys using the molecular interaction volume model\",\"authors\":\"Sanjay Kumar Sah, Ishwar Koirala\",\"doi\":\"10.1088/2399-6528/ad035a\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Abstract The activities of Sn in the liquid solder ternary alloy Sn-Au-Cu at 900 K have been computed using the molecular interaction volume model (MIVM). The calculated values have been compared with the experimental data for three cross-sections, i.e., for three different ratios of aurum to copper (XAu:XCu) = 3:1, 1:1, and 1:3. In addition, the excess Gibbs free energy of mixing, ΔGEx, for these ternary liquid alloys has been determined using the same model parameters to assess their validity. The resulting values have then been compared with the corresponding experimental data found in the literature. The agreement between the theoretical and experimental results has been found to be satisfactory.\",\"PeriodicalId\":47089,\"journal\":{\"name\":\"Journal of Physics Communications\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":1.1000,\"publicationDate\":\"2023-10-13\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Physics Communications\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1088/2399-6528/ad035a\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"PHYSICS, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Physics Communications","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1088/2399-6528/ad035a","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"PHYSICS, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 0
摘要
摘要:采用分子相互作用体积模型(MIVM)计算了锡在液态钎料三元合金Sn- au - cu中900 K时的活度。将计算值与实验数据进行了对比,即在三种不同的金铜比(XAu:XCu) = 3:1、1:1和1:3的情况下。此外,用相同的模型参数测定了这些三元液态合金的过量混合吉布斯自由能ΔGEx,以评估其有效性。然后将所得值与文献中相应的实验数据进行比较。理论与实验结果吻合较好。
Computational assessment of Sn activities and integral excess free energy change for mixing in the Sn-Au-Cu ternary liquid alloys using the molecular interaction volume model
Abstract The activities of Sn in the liquid solder ternary alloy Sn-Au-Cu at 900 K have been computed using the molecular interaction volume model (MIVM). The calculated values have been compared with the experimental data for three cross-sections, i.e., for three different ratios of aurum to copper (XAu:XCu) = 3:1, 1:1, and 1:3. In addition, the excess Gibbs free energy of mixing, ΔGEx, for these ternary liquid alloys has been determined using the same model parameters to assess their validity. The resulting values have then been compared with the corresponding experimental data found in the literature. The agreement between the theoretical and experimental results has been found to be satisfactory.