کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
5409943 1506548 2016 24 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
An analytical equation of state for ammonia at high temperatures and high pressures
ترجمه فارسی عنوان
معادله تحلیلی حالت آمونیاک در دماهای بالا و فشار بالا
کلمات کلیدی
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی تئوریک و عملی
چکیده انگلیسی
An analytical equation of state is presented for ammonia to describe its thermodynamic properties over wide ranges of temperatures and pressures up to 3000 K and 20 GPa, respectively. The equation of state contains well-defined parameters, two of which have been slightly adjusted around their global values based on a limited set of experimental data. The properties of ammonia predicted by the new equation of state are in very good agreement with the experimental data and the first-principles molecular dynamics simulation results over a broad range of temperatures and pressures. The new equation of state is expected to supplement molecular simulations at conditions where experimental data are not yet available.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Molecular Liquids - Volume 222, October 2016, Pages 733-738
نویسندگان
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