Density functional theory studies of the core excited energies of HgBa2CaCu2O6+δ

被引：0

作者：

Lu, J. ^{[1
]}

Zhang, S. ^{[1
]}

Zhang, L. ^{[1
]}

Li, J. ^{[1
]}

Zhang, X. ^{[1
]}

Zhao, X. ^{[1
]}

机构：

[1] Mesoscopic Physics Laboratory, Department of Physics, Peking University, Beijing, 100871, China

来源：

Beijing Daxue Xuebao Ziran Kexue Ban/Acta Scientiarum uaturalium Universitatis Pekinensis | 2001年 / 37卷 / 03期

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D O I：

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摘要：

Relativistic spin-polarized local density functional calculations have been performed for HgBa2CaCu2O6+δ. The calculated core excited energies essentially agree with the XPS spectra. The spin-orbit splittings are especially in satisfactory agreement with the observed ones.

引用

页码：336 / 339

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