Abstract

In this work we apply the recently developed real space scheme based on the recursion method and the LMTO-ASA formatism to investigate the dominant p valence contribution to the distribution of electric field gradient at the nucleus (EFG) in amorphons metals. The Zr eluster was obtained by random packing of spheres with periodic boundary conditions. We find that the distribution of EFG is over positive and negative values and has a gap around zero.

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 call

Disclaimer: 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.