Maximally localized Wannier functions in LaMnO3within PBE +U, hybrid functionals and partially self-consistent GW: an efficient route to constructab initiotight-binding parameters for egperovskites-Reference-Cited by-同舟云学术

Maximally localized Wannier functions in LaMnO3within PBE +U, hybrid functionals and partially self-consistent GW: an efficient route to constructab initiotight-binding parameters for egperovskites

Published:2012-05-11 Issue:23 Volume:24 Page:235602
ISSN:0953-8984
Container-title:Journal of Physics: Condensed Matter
language:
Short-container-title:J. Phys.: Condens. Matter

Author:

Franchini C,Kováčik R,Marsman M,Sathyanarayana Murthy S,He J,Ederer C,Kresse G

Publisher

IOP Publishing

Subject

Condensed Matter Physics,General Materials Science

Link

http://stacks.iop.org/0953-8984/24/i=23/a=235602/pdf

Reference86 articles.

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4. Neutron-diffraction study of the magnetic and orbital ordering in154SmNiO3and153EuNiO3

5. Volume collapse inLaMnO3caused by an orbital order-disorder transition

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