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M. Mahdouani

affiliation not provided to SSRN

SCHOLARLY PAPERS

1

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Scholarly Papers (1)

1.

Revealing of the Effect of Co/Cu(Dsp2/D7-9) Cationic Doping on an Electronic Acceptor Nanocage Surface for the Adsorption of Ca, Va, and Smx Ligands: Dft-D3, Qtaim, Igm-Nci, and Md Analysis

Number of pages: 66 Posted: 12 May 2023
University of Monastir, University of Carthage, King Khalid University, Hitit University, Hitit University, affiliation not provided to SSRN, Benemérita Universidad Autónoma de Puebla (BUAP), affiliation not provided to SSRN, University of Monastir, 8 Mai 1945 – Guelma University, University of Monastir, University of Carthage, University of Monastir and Wuhan Textile University
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Abstract:

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DFT-D3, Nanocages-ligands, Adsorptions sites, Charge transfer, IGM-NCI, QTAIM-ELF.