کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
5389081 1505127 2007 4 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Predicting the formation enthalpies of binary intermetallic compounds
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی تئوریک و عملی
پیش نمایش صفحه اول مقاله
Predicting the formation enthalpies of binary intermetallic compounds
چکیده انگلیسی
A model is improved for predicting the formation enthalpies of binary transition metal systems and testified by comparing with the recently reported experimental data. The predictions by the improved model are in better agreement with 362 experimental data while comparing with Miedema's theory. In addition, the predictive ability has also been addressed by comparing with ab initio calculations. A systematic analysis shows that the improved model is a reliable semi-quantitative method for predicting the formation enthalpy of intermetallic compounds with a reasonable statistical precise.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Chemical Physics Letters - Volume 442, Issues 4–6, 17 July 2007, Pages 511-514
نویسندگان
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