Symmetry lowering by cage doping in spherical superatoms Evaluation of electronic and optical properties of 18-electron W@Au12Ptn (n=0-4) superatomic clusters from relativistic DFT calculations - Université de Rennes Accéder directement au contenu
Article Dans Une Revue International Journal of Quantum Chemistry Année : 2019

Symmetry lowering by cage doping in spherical superatoms Evaluation of electronic and optical properties of 18-electron W@Au12Ptn (n=0-4) superatomic clusters from relativistic DFT calculations

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hal-02049510 , version 1 (26-02-2019)

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Franck Gam, Ramiro Arratia-Perez, Samia Kahlal, Jean-Yves Saillard, Alvaro Munoz-Castro. Symmetry lowering by cage doping in spherical superatoms Evaluation of electronic and optical properties of 18-electron W@Au12Ptn (n=0-4) superatomic clusters from relativistic DFT calculations. International Journal of Quantum Chemistry, 2019, 119 (6), ⟨10.1002/qua.25827⟩. ⟨hal-02049510⟩
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