Cation polarizability from first-principles: Sn2+
Generalized Gradient Corrected Density Functional Theory calculations have been performed on SnO in the gas phase. The total charge density of the molecular system has been partitioned between Sn and O using a Wannier localization transformation of the Kohn Sham eigenvectors, and the single-ion dipo...
| Hlavní autoři: | , , |
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| Médium: | Journal article |
| Jazyk: | English |
| Vydáno: |
2001
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