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Browsing by Subject "Total-Energy Calculations"

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Browsing by Subject "Total-Energy Calculations"

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    Effect of Linker Distribution in the Photocatalytic Activity of Multivariate Mesoporous Crystals 
    Lerma-Berlanga, Belen; Ganivet, Carolina R.; Almora-Barrios, Neyvis; Tatay, Sergio; Peng, Yong; Albero-Sancho, Josep; Fabelo, Oscar; Gonzalez-Platas, Javier; García Gómez, Hermenegildo; Padial, Natalia M.; Marti-Gastaldo, Carlos (American Chemical Society, 2021-01-12)
    [EN] The use of Metal-Organic Frameworks as crystalline matrices for the synthesis of multiple component or multivariate solids by the combination of different linkers into a single material has emerged as a versatile route ...