Abstract
The transition process from ordered SmCo 5 (CaCu 5-type) to disordered SmCo 7 (TbCu 7-type) is successfully simulated by using inverted ab initio pair potentials. The structure properties of this disordered TbCu 7-type compound, including lattice constants, X-ray diffraction, phase stability, site preference have been calculated and the calculated results are in good agreement with the experimental data. Also, a new structure deformation of 3g sublattice in SmCo 7− x Ti x is reported.
Sign-in/Register to access full text options 
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a callDisclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.
