First-principles study of structural, electronic, elastic, and thermal properties of Imm2-BC Project supported by the National Basic Research Program of China (Grant No. 2013CB632900), the Science and Technology Planning Project of Sichuan Province, China (Grant Nos. 2018JY0422 and 2018JY0325), the Department of Education of Sichuan Province, China (Grant No. 18ZA0290), and the Doctor Research Start-up Foundation of Panzhihua University, China (Grant No. 0210600049). |
The calculated lattice thermal conductivity for Imm2 BC using first-principles method. |