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机译:
Kimika Fakultatea, Euskal Herriko Unibertsitatea (UPV/EHU) and Donostia International Physics Center (DIPC), P. K. 1072, 20080 Donostia, Euskadi, Spain;
Computational Laboratory for Hybrid/Organic Photovoltaics (CLHYO), Istituto CNR di Scienze e Tecnologie Molecolari (ISTM-CNR), Via Elce di Sotto 8, 06123 Perugia, Italy;
机译:A comparison of water-gas shift reaction on ZnO (1010) surface and 6Cu cluster deposited over ZnO (1010) surface using density functional theory studies
机译:Design and Synthesis of Novel Indole and Carbazole Based Organic Dyes for Dye Sensitized Solar Cells: Theoretical Studies by DFT/TDDFT
机译:Pyrazinamide Drug Adsorption on the Pristine and Doped C70 Fullerenes: A DFT/TDDFT Study
机译:six-dimensional quantum dynamics study for the dissociative adsorption of HCl on au(111) surface