کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
1664470 1008758 2015 6 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Generation and properties of bulk a-ZrO2 by molecular dynamics simulations with a reactive force field
موضوعات مرتبط
مهندسی و علوم پایه مهندسی مواد فناوری نانو (نانو تکنولوژی)
پیش نمایش صفحه اول مقاله
Generation and properties of bulk a-ZrO2 by molecular dynamics simulations with a reactive force field
چکیده انگلیسی
A classic molecular dynamic melting and cooling approach was used to generate bulk amorphous ZrO2 using a reactive force field. The density and the structure characteristics of the generated bulk ZrO2 were analyzed and compared with literature simulations and experimental data. The density dependence on the cooling rate in the simulations was established. The generated bulk ZrO2 can further be used for theoretical studies of amorphous ZrO2 properties.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Thin Solid Films - Volume 594, Part A, 2 November 2015, Pages 172-177
نویسندگان
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