排序方式: 共有4条查询结果,搜索用时 15 毫秒
1
1.
采用正电子寿命谱和双探头Doppler展宽测量在原子尺度上研究了α-Fe/Nd2Fe14B复合纳米晶的界面结构.正电子寿命研究表明, α-Fe/Nd2Fe14B复合纳米晶存在两类界面.一类为非晶界面层, 正电子湮没寿命为155 ps; 另一类为具有原子空位的松懈界面, 含有空位尺寸大于1~2个铁原子空位的结构自由体积, 正电子湮没寿命为246 ps.电子-正电子湮没光子的共谐Doppler展宽测量表明这类松懈界面富集非磁性原子Nd和B, 这将削弱α-Fe/Nd2Fe14B复合纳米晶晶粒间的磁交换耦合. 相似文献
2.
By means of first principle total energy calculations, this paper studies the structural transition, elastic, mechanical, dielectric and electronic properties of BeCN2. The calculations in total energy indicate that under ambient condition, the orthorhombic BeSiN2-type BeCN2 (space group Pna21) is a more favoured structure than the tetragonal chalcopyrite-type one (space group I-42d). The results of elastic properties reveal that BeCN2 in both orthorhombic and tetragonal structure has higher bulk and shear moduli and smaller Poisson's ratio. The calculated Vicker hardness of tetragonal phase is 36.8 GPa, indicating a hard material. The analyses of electronic structure and electron density difference demonstrate that these excellent mechanical properties are attributed to the stronger covalent-bonding of CN4 and BeN4 subunits in BeCN2 crystal. Also, the orthorhombic BeCN2 phase is found to be a transparent semiconductor material with the calculated direct band gap of about 5.56 eV, superior to the indirect band gap of diamond and c-BN. Moreover, it also calculates Born effective charges and dielectric constants of BeCN2. These results suggest that BeCN2 may have some useful applications as optoelectronic, optical window and wear resistant materials. 相似文献
3.
4.
采用正电子寿命谱和双探头Doppler展宽测量在原子尺度上研究了α-Fe,Nd2Fel4B复合纳米晶的界面结构。正电子寿命研究表明,α-Fe/Nd2Fel4B复合纳米晶存在两类界面。一类为非晶界面层,正电子湮没寿命为155ps;另一类为具有原子空位的松懈界面,含有空位尺寸大于-2个铁原子空位的结构自由体积,正电子湮没寿命为246ps。电子-正电子湮没光子的共谐Doppler展宽测量表明这类松懈界面富集非磁性原子Nd和B,这将削弱α-Fe/Nd2Fel4B复合纳米晶晶粒间的磁交换耦合。 相似文献
1