Browsing by Author "Zarate, X."
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- ItemA novel series of pyrazole derivatives toward biological applications: experimental and conceptual DFT characterization(2022) Ortiz, P.D.; Castillo-Rodriguez, J.; Tapia, J.; Zarate, X.; Vallejos, G.A.; Roa, V.; Molins, E.; Bustos, C.; Schott Verdugo, Eduardo Enrique
- ItemAlkoxide structure effect on size and size distribution of Ag, Au and Ag@Au nanoparticles, prepared via alkoxide mild reduction in water(2020) Ortiz Rodríguez, Pedro David; Castillo Rodríguez, Judith; Diaz Garcia, A. M.; Martin Trasanco, R.; Zarate, X.; Benito, M.; Molins, E.; Schott Verdugo, Eduardo Enrique
- ItemBehavior of the SDS/1-butanol and SDS/2-butanol mixtures at the water/n-octane interface through molecular dynamics simulations(2019) Parra, J.G.; Aray, Y.R.; Iza, P.; Zarate, X.; Schott Verdugo, Eduardo Enrique
- ItemConversion of levulinic acid over Ag substituted LaCoO3 perovskite(2021) Seguel, J.; Leal, E.; Zarate, X.; Saavedra-Torres, M.; Schott Verdugo, Eduardo Enrique; Díaz de León, J.N.; Blanco, E.; Escalona, N.; Pecchi, G.; Sepúlveda, C.
- ItemConversion of succinic acid over Ni and Co catalysts(2021) Rojas Guerrero, Mabel Natalia; Zarate, X.; Canales Muñoz, Roberto; Dongil, A. B.; Pazo Carballo, César Alexander; Saavedra Torres, M.; Escalona, Néstor
- ItemCorrection: Quantum chemical elucidation of the turn-on luminescence mechanism in two new Schiff bases as selective chemosensors of Zn2+: Synthesis, theory and bioimaging applications (RSC Advances (2019) 9 (30778-30789) DOI: 10.1039/C9RA05010H)(2019) Berrones-Reyes, J.C.; Muñoz-Flores, B.M.; Cantón-Diáz, A.M.; Treto-Suárez, M.A.; Páez-Hernández, D.; Schott Verdugo, Eduardo Enrique; Zarate, X.; Jiménez-Pérez, V.M.
- ItemCorrigendum to “Structural and interfacial properties of the CO2-in-water foams prepared with sodium dodecyl sulfate (SDS): A molecular dynamics simulation study” [Colloids Surf. A 578 (2019) 615](S0927775719305989)(10.1016/j.colsurfa.2019.123615)(2020) Parra, J.G.; Dominguez, H.; Aray, Y.; Iza, P.; Zarate, X.; Schott Verdugo, Eduardo Enrique
- ItemCyanobacterial biomass as a potential biosorbent for the removal of recalcitrant dyes from water(2021) Diaz-Uribe, C.; Angulo, B.; Patiño, K.; Hernández, V.; Vallejo, W.; Gallego-Cartagena, E.; Romero Bohórquez, A.R.; Zarate, X.; Schott Verdugo, Eduardo Enrique
- ItemDesign, characterization and quantum chemical computations of a novel series of pyrazoles derivatives with potential anti-proinflammatory response(2020) Burboa-Schettino, P.; Bustos, C.; Molins, E.; Figueroa, X.F.; Llanquinao, J.; Zarate, X.; Vallejos, G.; Diaz-Uribe, C.; Vallejo, W.; Schott Verdugo, Eduardo Enrique
- ItemElectro-reduced graphene oxide nanosheets coupled with RuAu bimetallic nanoparticles for efficient hydrogen evolution electrocatalysis(2021) Khalid, M.; Zarate, X.; Saavedra-Torres, M.; Schott Verdugo, Eduardo Enrique; Maria Borges Honorato, A.; Rafe Hatshan, M.; Varela, H.
- ItemExperimental and DFT study of natural curcumin derived dyes as n-type sensitizers(2021) Zarate, X.; González P, I.; Caramori, S.; Benazzi, E.; Barra, T.; Arrue, L.; Wu, Y.-N.; Díaz-Uribe, C.; Vallejo, W.; Schott Verdugo, Eduardo Enrique
- ItemFluorescence turn-on and turn-off mechanisms of a dual-selective chemosensor of Bi3+ and pH changes: Insights from a theoretical perspective(2021) Treto-Suárez, M.A.; Hidalgo-Rosa, Y.; Schott Verdugo, Eduardo Enrique; Páez-Hernández, D.; Zarate, X.
- ItemImproving the Photocatalytic Properties of Tio2 Thin Films Modified with Anderson-Type Polyoxometallates (Cr, Co and Ni): Experimental and Dft Study(2022) Zarate, X.; Diaz-Uribe, C.; Duran, F.; Vallejo, W.; Puello, E.; Schott Verdugo, Eduardo Enrique
- ItemInfluence of axle length on the rate and mechanism of shuttling in rigid H-shaped [2]rotaxanes(2017) Gholami, G.; Zhu, K.; Baggi, G.; Schott Verdugo, Eduardo Enrique; Zarate, X.; Loeb, S.
- ItemInfluence of LiTaO3(0001) and KTaO3(001) Perovskites Structures on the Molecular Adsorption of Styrene and Styrene oxide: A Theoretical Insight by Periodic DFT Calculations(2022) Toledo, F.; Schott Verdugo, Eduardo Enrique; Saavedra-Torres, M.; Delgado, E.; Pecchi, G.; Zarate, X.
- ItemInsights into the selective sensing mechanism of a luminescent Cd(II)-based MOF chemosensor toward NACs: roles of the host–guest interactions and PET processes(2021) Hidalgo-Rosa, Y.; Mena-Ulecia, K.; Treto-Suárez, M.A.; Schott Verdugo, Eduardo Enrique; Páez-Hernández, D.; Zarate, X.
- ItemMagnetic response and its relation to the keto-enol tautomerism of 3,3 '-(1,4-phenylene)bis(pentane-2,4-dione) : Experimental and theoretical insights(2020) Lancheros Sánchez, Andrés Fernando; Zarate, X.; Schott Verdugo, Eduardo Enrique
- ItemModulation of CO2adsorption in novel pillar-layered MOFs based on carboxylate-pyrazole flexible linker(2021) Lancheros, A.; Goswami, S.; Mian, M.R.; Zhang, X.; Zarate, X.; Schott Verdugo, Eduardo Enrique; Farha, O.K.; Hupp, J.T.
- ItemNew Sensitive and Selective Chemical Sensors for Ni2+ and Cu2+ Ions : Insights into the Sensing Mechanism through DFT Methods(2020) Treto Suarez, M. A.; Tapia, J.; Hidalgo Rosa, Y.; Paez Hernandez, D.; Molins, E.; Zarate, X.; Schott Verdugo, Eduardo Enrique
- ItemNew thiophene-based poly(azomethine)s bearing tetraphenylsilane moieties along their backbone. Optical, electronic, thermal properties and theoretical calculations(2020) Sobarzo Aucal, Patricio Antonio; Jessop Rivera, Ignacio; Mariman, A. P.; Gonzalez, A. F.; Saldias, C.; Schott Verdugo, Eduardo Enrique; Zarate, X.; Hauyón Sepúlveda, René Alejandro; Recabarren Gajardo, Gonzalo; Terraza Inostroza, Claudio; González Enríquez, Carmen; Tundidor Camba, Alain