Stabilizing heteroatom-centered 16-vertex group 11 tetrahedral architectures Bonding and structural considerations toward versatile endohedral species

Franck Gam 1, 2 Ramiro Arratia-Perez 1 Samia Kahlal 2 Jean-Yves Saillard 2 Alvaro Munoz-Castro 3
1 Universidad Andrés Bello - UNAB (CHILE)
2 ISCR - Institut des Sciences Chimiques de Rennes
3 Universidad Autonoma de Chile
Keywords : heteroatom doping DFT superatoms tetrahedral structure
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Journal articles
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https://hal-univ-rennes1.archives-ouvertes.fr/hal-02278398
Contributor : Laurent Jonchère <>
Submitted on : Wednesday, September 4, 2019 - 1:17:27 PM
Last modification on : Tuesday, November 12, 2019 - 4:51:29 PM

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UNIV-RENNES1 | ISCR | CNRS | UR1-UFR-SPM | INC-CNRS | UNIV-RENNES | INSA-GROUPE

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Franck Gam, Ramiro Arratia-Perez, Samia Kahlal, Jean-Yves Saillard, Alvaro Munoz-Castro. Stabilizing heteroatom-centered 16-vertex group 11 tetrahedral architectures Bonding and structural considerations toward versatile endohedral species. International Journal of Quantum Chemistry, Wiley, 2019, 119 (24), ⟨10.1002/qua.26038⟩. ⟨hal-02278398⟩

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