HIGHLIGHTS
- who: Benyuan Ma and colleagues from the Physics and Electronic Engineering Department, Xinxiang University, Xinxiang, People's Republic of China have published the Article: First-principles calculations of structural, electronic, magnetic and elastic properties of Mo2FeB2 under high pressure, in the Journal: (JOURNAL) of 08/09/2022
- how: In this work the unit cell that contains 4 Mo atoms 2 Fe atoms and 4 B atoms with periodic boundary conditions was used.
SUMMARY
The AF ground_state was first set before the geometric optimization. Calculation method and crystal_structure rsos.royalsocietypublishing.org R . . .
If you want to have access to all the content you need to log in!
Thanks :)
If you don't have an account, you can create one here.