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      Oxidation energies of transition metal oxides within the\(\mathrm{GGA}+\mathrm{U}\)framework

      , ,
      Physical Review B
      American Physical Society (APS)

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          Efficient iterative schemes forab initiototal-energy calculations using a plane-wave basis set

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            From ultrasoft pseudopotentials to the projector augmented-wave method

            Physical Review B, 59(3), 1758-1775
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              Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

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                Author and article information

                Journal
                PRBMDO
                Physical Review B
                Phys. Rev. B
                American Physical Society (APS)
                1098-0121
                1550-235X
                May 2006
                May 4 2006
                : 73
                : 19
                Article
                10.1103/PhysRevB.73.195107
                fa8caa56-6730-4477-b8b8-2d3e6120a9b4
                © 2006

                http://link.aps.org/licenses/aps-default-license

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