most citedThe calculation of the effective interaction parameter in LDA+U method by linear response approach for Fe(OH)2

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cond-mat.mtrl-sci2008★ 1 cited

The calculation of the effective interaction parameter in LDA+U method by linear response approach for Fe(OH)2

Mansoureh Pashangpour, Khadijeh Imani, Amir Abbas Sabouri-Dodaran +1

In this paper we have investigated the electronic properties of Fe(OH)2 hydroxide by using the LSDA+U as well as the generalized gradient approximation. Our calculations for the ir…