Ab initiopseudopotential plane-wave calculations of the electronic structure ofYBa2Cu3O7
نویسندگان
چکیده
منابع مشابه
Ab initio pseudopotential plane-wave calculations of the electronic structure of YBa2Cu3O7.
We present an ab initio pseudopotential local density functional calculation for stoichiometric high-Tc cuprate YBa2Cu3O7 using the plane-wave basis set. We have overcome well-known difficulties in applying pseudopotential methods to first-row elements, transition metals, and rare-earth materials by carefully generating norm-conserving pseudopotentials with excellent transferability and employi...
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ژورنال
عنوان ژورنال: Physical Review B
سال: 1995
ISSN: 0163-1829,1095-3795
DOI: 10.1103/physrevb.51.3886