Publication Date:
2018-01-11
Description:
Author(s): Kenji Nawa, Toru Akiyama, Tomonori Ito, Kohji Nakamura, Tamio Oguchi, and M. Weinert The first-principles calculation of correlated materials within density functional theory remains challenging, but the inclusion of a Hubbard-type effective on-site Coulomb term ( U eff ) often provides a computationally tractable and physically reasonable approach. However, the reported values of U eff ... [Phys. Rev. B 97, 035117] Published Wed Jan 10, 2018
Keywords:
Electronic structure and strongly correlated systems
Print ISSN:
1098-0121
Electronic ISSN:
1095-3795
Topics:
Physics
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