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X. Zarate · SciRah

Researcher profile · Semantic Scholar

X. Zarate

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X. Zarate — researcher profile on SciRah

h-index: 23
Works: 198
Citations: 2,181

Most-cited papers

UiO-66(Zr) as drug delivery system for non-steroidal anti-inflammatory drugs.
Javier Salazar, Yoan Hidalgo-Rosa, Pia C. Burboa, Yi-Nan Wu +4 more
2024Journal of Controlled Release40 citations
Semantic Scholar
Electro-reduced graphene oxide nanosheets coupled with RuAu bimetallic nanoparticles for efficient hydrogen evolution electrocatalysis
M. Khalid, X. Zarate, M. Saavedra-Torres, Eduardo Schott +3 more
202136 citations Open access
Semantic Scholar
The role played by structural and energy parameters of β-Diketones derivatives as antenna ligands in Eu(III) complexes
Lily Arrué, Julián Santoyo-Flores, N. Pizarro, X. Zarate +2 more
202136 citations
Semantic Scholar
Modification of a commercial activated carbon with nitrogen and boron: Hydrogen storage application
Arturo Morandé, P. Lillo, É. Blanco, C. Pazo +7 more
2023Journal of Energy Storage31 citations
Semantic Scholar
Adsorption and Photocatalytic Degradation of Methylene Blue on TiO2 Thin Films Impregnated with Anderson-Evans Al-Polyoxometalates: Experimental and DFT Study
Freider Duran, Carlos Díaz-Uribe, W. Vallejo, Amner Muñoz-Acevedo +2 more
2023ACS Omega27 citations Open access
Semantic Scholar
Schiff bases and multidentate organic compounds as fluorescent sensors of Al3+: photophysical, fluorescent bioimaging and the mechanisms
Jessica C. Berrones-Reyes, B. M. Muñoz-Flores, Manuel A. Treto-Suárez, Yoan Hidalgo-Rosa +5 more
2022Annalen der Pharmacie25 citations
Semantic Scholar
Insights into the selective sensing mechanism of a luminescent Cd(II)-based MOF chemosensor toward NACs: roles of the host–guest interactions and PET processes
Yoan Hidalgo-Rosa, K. Mena-Ulecia, Manuel A. Treto-Suárez, Eduardo Schott +2 more
2021Journal of Materials Science23 citations
Semantic Scholar
Conversion of levulinic acid over Ag substituted LaCoO3 perovskite
J. Seguel, E. Leal, X. Zarate, M. Saavedra-Torres +6 more
202120 citations
Semantic Scholar
Organotin Schiff bases as halofluorochromic dyes: green synthesis, chemio-photophysical characterization, DFT, and their fluorescent bioimaging in vitro.
Margarita López-Espejel, A. Gómez-Treviño, B. M. Muñoz-Flores, Manuel A. Treto-Suárez +4 more
2021Journal of materials chemistry. B19 citations
Semantic Scholar
Removal and photocatalytic degradation of methylene blue on ZrO2 thin films modified with Anderson-Polioxometalates (Cr3+, Co3+, Cu2+): An experimental and theoretical study
Carlos Díaz-Uribe, Jiress Florez, W. Vallejo, Freider Duran +4 more
2024Journal of Photochemistry and Photobiology A: Chemistry18 citations
Semantic Scholar
Fluorescence turn-on and turn-off mechanisms of a dual-selective chemosensor of Bi3+ and pH changes: Insights from a theoretical perspective
Manuel A. Treto-Suárez, Yoan Hidalgo-Rosa, Eduardo Schott, D. Páez-Hernández +1 more
202118 citations
Semantic Scholar
Unveiling the hydrophilic nature of SDS surfactant through molecular simulations: Exploring the influence of charge distribution on interfacial properties in the vacuum/SDS/water system
J. G. Parra, P. Iza, Héctor Domínguez, Eduardo Schott +1 more
2024Journal of Molecular Liquids17 citations
Semantic Scholar
Photocatalytic Degradation of Methylene Blue under Visible Light Using TiO2 Thin Films Impregnated with Porphyrin and Anderson-Type Polyoxometalates (Cu and Zn)
Alexander Sanguino, Carlos Díaz-Uribe, Freider Duran, W. Vallejo +6 more
2022Catalysts17 citations Open access
Semantic Scholar
Expanding the Knowledge of the Selective-Sensing Mechanism of Nitro Compounds by Luminescent Terbium Metal-Organic Frameworks through Multiconfigurational ab Initio Calculations.
Yoan Hidalgo-Rosa, K. Mena-Ulecia, Manuel A. Treto-Suárez, Eduardo Schott +2 more
2022Journal of Physical Chemistry A16 citations
Semantic Scholar
The ferryl generation by fenton reaction driven by catechol.
Francisca J. Benítez, V. Melin, Gabriel Pérez-González, Adolfo Henríquez +3 more
2023Chemosphere15 citations
Semantic Scholar
Tuning the sensitization pathway T1→5DJ in Eu-based MOF through modification of the antenna ligand. A theoretical approach via multiconfigurational quantum calculations
Yoan Hidalgo-Rosa, Julián Santoyo-Flores, Manuel A. Treto-Suárez, Eduardo Schott +2 more
2023Journal of Luminescence14 citations
Semantic Scholar
Cyanobacterial Biomass as a Potential Biosorbent for the Removal of Recalcitrant Dyes from Water
Carlos Díaz-Uribe, Barni Angulo, K. Patiño, V. Hernández +5 more
2021Water14 citations Open access
Semantic Scholar
Adsorption properties of M-UiO-66 (M = Zr(IV); Hf(IV) or Ce(IV)) with BDC or PDC linker.
Diego González, César Pazo-Carballo, E. Camú, Yoan Hidalgo-Rosa +3 more
2024Dalton Transactions13 citations Open access
Semantic Scholar
Zn(II)-tetracarboxy-phthalocyanine-Sensitized TiO2 Thin Films as Antimicrobial Agents under Visible Irradiation: a Combined DFT and Experimental Study
W. Vallejo, Karen Navarro, Carlos Díaz-Uribe, Eduardo Schott +2 more
2021ACS Omega13 citations Open access
Semantic Scholar
A new zero-dimensional (0D) hybrid bismuth (III) halide: Synthesis, crystal structure, thermal analysis, photophysical properties and DFT calculations
Selma Msaoura, M. Benito, Elies Molins, K. Khirouni +5 more
2024Journal of Molecular Structure12 citations
Semantic Scholar
Tunable optical properties of isoreticular UiO-67 MOFs for photocatalysis: a theoretical study.
Manuel A. Treto-Suárez, Yoan Hidalgo-Rosa, M. Saavedra-Torres, Bryan D. Koivisto +4 more
2024Dalton Transactions12 citations Open access
Semantic Scholar
Theoretical and Experimental Study for Cross-Coupling Aldol Condensation over Mono- and Bimetallic UiO-66 Nanocatalysts
César Pazo-Carballo, É. Blanco, E. Camú, Á. Leiva +5 more
2023ACS Applied Nano Materials12 citations
Semantic Scholar
Evaluation of the affinity of asphaltene molecular models A1 and A2 by the water/oil interfaces based on a novel concept of solubility parameter profiles obtained from MD simulations
J. G. Parra, G. Rodriguez, P. Iza, X. Zarate +1 more
2023Journal of Molecular Liquids12 citations
Semantic Scholar
Experimental and DFT study of natural curcumin derived dyes as n-type sensitizers
X. Zarate, P. IvanGonzález, S. Caramori, E. Benazzi +6 more
202112 citations
Semantic Scholar
A novel series of pyrazole derivatives toward biological applications: experimental and conceptual DFT characterization
Pedro D. Ortiz, J. Castillo-Rodriguez, J. Tapia, X. Zarate +5 more
2021Molecular diversity12 citations
Semantic Scholar
Study of methylene blue removal and photocatalytic degradation on zirconia thin films modified with Mn-Anderson polyoxometalates.
Jiress Florez, Carlos Díaz-Uribe, W. Vallejo, Freider Duran +4 more
2025Dalton Transactions11 citations Open access
Semantic Scholar
Thiophene- and bithiophene-based π-conjugated Schiff base oligomers containing binaphthalene moieties in the backbone. Properties and computational simulations
Alexis F. González, A. Mariman, R. Hauyon, Danitza Pavez-Lizana +9 more
2024Polymer Chemistry11 citations
Semantic Scholar
New Pillar-MOF with Nitrogen-Donor Sites for CO2 Adsorption
A. Lancheros, S. Goswami, X. Zarate, É. Blanco +2 more
2024Crystal Growth & Design11 citations
Semantic Scholar
Tetraphenylsilane-based oligo(azomethine)s containing 3,4-ethylenedioxythiophene units along their backbone: Optical, electronic, thermal properties and computational simulations
P. Sobarzo, Alexis F. González, I. Jessop, R. Hauyon +7 more
2022European Polymer Journal11 citations
Semantic Scholar
Tunning the optical properties of a Photocatalytic Metal-Organic Framework by means of molecular modelling
Manuel A. Treto-Suárez, Eduardo Schott, D. Páez-Hernández, X. Zarate +3 more
2022New Journal of Chemistry10 citations
Semantic Scholar
Photodynamic effect of 5,10,15,20-tetrakis(4-carboxyphenyl)porphyrin and (Zn2+ and Sn4+) derivatives against Leishmania spp in the promastigote stage: experimental and DFT study
Fabián Espitia-Almeida, Carlos Díaz-Uribe, W. Vallejo, O. Peña +4 more
2021Chemické zvesti10 citations
Semantic Scholar
Insights into Hydrodeoxygenation of Furfural and Guaiacol Mixture: Experimental and Theoretical Studies
E. Schiesser, É. Blanco, A. B. Dongil, X. Zarate +4 more
202110 citations
Semantic Scholar
The adsorption of furfural on SrTiO3 and SrCoxTi1-xO3 perovskites: A DFT study within the molecular cluster approach
F. Toledo, Ignacio Lizana, A. Buljan, X. Zarate +2 more
202110 citations
Semantic Scholar
Modulation of CO2 adsorption in novel pillar-layered MOFs based on carboxylate-pyrazole flexible linker.
A. Lancheros, S. Goswami, M. R. Mian, Xuan Zhang +4 more
2021Dalton Transactions10 citations Open access
Semantic Scholar
A Computational Chemistry Approach to the Molecular Design of SiO2 Nanoparticles Coated with Stearic Acid and Sodium Stearate in Ethanol Solvent
Gabriela L. Galarza-Acosta, J. G. Parra, R. Hernández-Bravo, P. Iza +4 more
2023Colloids and Surfaces A: Physicochemical and Engineering Aspects9 citations Open access
Semantic Scholar
Photophysical characterization and in vitro anti-leishmanial effect of 5,10,15,20-tetrakis(4-fluorophenyl) porphyrin and the metal (Zn(II), Sn(IV), Mn(III) and V(IV)) derivatives
Fabián Espitia-Almeida, Carlos Díaz-Uribe, W. Vallejo, Doris Gómez-Camargo +3 more
2022Biometals9 citations
Semantic Scholar
Photocatalytic study of TiO2 Thin Films Modified with Anderson-Type Polyoxometalates (Cr, Co and Ni): Experimental and DFT study
Carlos Díaz-Uribe, Freider Duran, W. Vallejo, Esneyder Puello +2 more
2022Polyhedron9 citations
Semantic Scholar
Exploring electronic structure and photophysical properties of metalloporphyrin-based metal–organic frameworks for photocatalysis: A quantum chemistry study
Yoan Hidalgo-Rosa, M. Saavedra-Torres, Bryan D. Koivisto, Manuel A. Treto-Suárez +3 more
2024Inorganic Chemistry Communications7 citations
Semantic Scholar
Catalytic evaluation of MOF-808 with metallic centers of Zr(IV), Hf(IV) and Ce(IV) in the acetalization of benzaldehyde with methanol.
Yazmín Arellano, C. Pazo, Vanesa Roa, Yoan Hidalgo-Rosa +4 more
2024Dalton Transactions7 citations Open access
Semantic Scholar
Synthesis, Structure, and Luminescence Properties of a 0D Organic-Inorganic Cadmium iodide: Combined Experimental and Theoretical Approach
Amna Fandouli, N. Ben Hamadi, A. Guesmi, E. C. Sañudo +5 more
2024Journal of Molecular Structure7 citations
Semantic Scholar
Tuning the visible-NIR absorption of azulenocyanine-based photosensitizers
Kevin Granados-Tavera, Michael Zambrano-Angulo, Yoan Hidalgo-Rosa, X. Zarate +1 more
2022Journal of Molecular Modeling7 citations
Semantic Scholar
The quest for a bidirectional auxetic, elastic, and enhanced fracture toughness material: Revisiting the mechanical properties of the BeH2 monolayers
A. Morin-Martinez, Jessica Arcudia, X. Zarate, M. E. Cifuentes-Quintal +1 more
2022Journal of Computational Chemistry7 citations
Semantic Scholar
Quantum chemical elucidation of the luminescence mechanism in a europium(III) co-doped UiO-66 chemosensor selective to mercury(II).
Yoan Hidalgo-Rosa, Yoslainy Echevarria-Valdés, M. Saavedra-Torres, D. Páez-Hernández +2 more
2025Dalton Transactions6 citations Open access
Semantic Scholar
Photophysical characterization of tetrahydroxyphenyl porphyrin Zn(II) and V(IV) complexes: experimental and DFT study
Carlos Díaz-Uribe, Daily Rangel, W. Vallejo, R. Valle +3 more
2023Biometals6 citations
Semantic Scholar
Synthesis and theoretical study of a new family of pyrazole derivative
J. Salazar-Muñoz, X. Zarate, Javier Sotomayor-Jaramillo, Carlos Bustos +1 more
2023Journal of Molecular Structure6 citations
Semantic Scholar
Structure and Electronic Properties of Benzimidazole and Cycloheptaimidazole Gold N-heterocyclic Carbenes
X. Zarate, L. Pop, Manuel A. Treto-Suárez, J. Tapia +1 more
20216 citations
Semantic Scholar
Theoretical and kinetic study of the singlet oxygen quenching reaction by hesperidin isolated from mandarin (Citrus reticulata) fruit peels
Carlos Díaz-Uribe, W. Vallejo, Teylis Hoz, Jiress Florez +3 more
2021Chemické zvesti6 citations
Semantic Scholar
Exploring the impact of short-chain alcohols and NaCl concentration on the interfacial properties of the water/SDBS surfactant/n-octane system: A molecular insight into the preparation of emulsified systems using MD simulations
J. G. Parra, P. Iza, Hector Domínguez, Geraldine Rodríguez +3 more
2025Chemical Engineering and Science5 citations
Semantic Scholar
Fluorescent B(III) and Sn(IV) Schiff Base: Synthesis, Photophysical Properties, Emergent Behavior, Applications, and Fluorescence Mechanism,
Marisol Ibarra-Rodríguez, V. M. Jiménez-Pérez, Jesús A. Lara-Cerón, Areli A. Molina-Paredes +6 more
2025Dyes and pigments5 citations
Semantic Scholar
Antimicrobial Activity against Fusarium oxysporum f. sp. dianthi of TiO2/ZnO Thin Films under UV Irradiation: Experimental and Theoretical Study
C. Quiñones, M. Posada, Angie Hormiga, Julian Peña +6 more
2024ACS Omega5 citations Open access
Semantic Scholar

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Yoan Hidalgo-Rosa×15
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Carlos Díaz-Uribe×13
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W. Vallejo×13
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D. Páez-Hernández×12

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Manuel A. Treto-Suárez×11

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M. Saavedra-Torres×8

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Freider Duran×5

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