کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
1815738 | 1025670 | 2006 | 5 صفحه PDF | دانلود رایگان |
عنوان انگلیسی مقاله ISI
First-principles study of magnetism in NpRhAl
دانلود مقاله + سفارش ترجمه
دانلود مقاله ISI انگلیسی
رایگان برای ایرانیان
کلمات کلیدی
موضوعات مرتبط
مهندسی و علوم پایه
فیزیک و نجوم
فیزیک ماده چگال
پیش نمایش صفحه اول مقاله
![عکس صفحه اول مقاله: First-principles study of magnetism in NpRhAl First-principles study of magnetism in NpRhAl](/preview/png/1815738.png)
چکیده انگلیسی
First-principles calculations based on density-functional theory were performed for the compound NpRhAl for the first time. The electronic density of states, bonding properties and equilibrium volume were studied using relativistic full-potential APW plus local orbitals calculations. The magnetocrystalline anisotropy energy was estimated from total-energy calculations and the c-axis was predicted to be the easy axis of magnetization. Finally, we employed the LSDA+U method to mimic orbital polarization and to obtain the correct total magnetic moments in experimental equilibrium.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Physica B: Condensed Matter - Volume 371, Issue 2, 31 January 2006, Pages 332-336
Journal: Physica B: Condensed Matter - Volume 371, Issue 2, 31 January 2006, Pages 332-336
نویسندگان
M. Diviš,