کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
5375974 1389343 2008 8 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Calculation of the binary diffusion coefficient and interaction viscosity of the H-H2 system
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی تئوریک و عملی
پیش نمایش صفحه اول مقاله
Calculation of the binary diffusion coefficient and interaction viscosity of the H-H2 system
چکیده انگلیسی
The hybrid-MMA was used to calculate the cross-sections that govern the binary diffusion coefficient and the interaction viscosity of the H-H2 system. The results were compared with the existing quantum IOSA calculations. The agreement is excellent for temperatures above 500 K. The present results were also compared with the 'exact' CC calculations. The agreement is very good below 1000 K, but progressively fails at elevated temperatures. The differences observed, with increasing temperature, can be attributed to a combination of the decreasing accuracy of a particular CC calculation and the expected failure of the MMA/IOSA family of methods when applied to light systems at high temperature.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Chemical Physics - Volume 345, Issue 1, 3 April 2008, Pages 41-48
نویسندگان
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