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Cerón, María LuisaHerrera, BarbaraAraya Figueroa, PauloGracia Caroca, FranciscoToro Labbé, Alejandro[Influence of the monoclinic and tetragonal zirconia phases on the water gas shift reaction. A theoretical study]
Ortega, Daniela E.Cortés Arriagada, DiegoTrofymchuk, Oleksandra S.Yepes, DianaGutiérrez Oliva, SoledadRojas Guerrero, RenéToro Labbé, Alejandro[The Role of Co‐Activation and Ligand Functionalization in Neutral Methallyl Nickel(II) Catalysts for Ethylene Oligomerization and Polymerization]The Role of Co‐Activation and Ligand Functionalization in Neutral Methallyl Nickel(II) Catalysts for Ethylene Oligomerization and Polymerization
Ortega Moo, CristinDurán, RocioHerrera Pisani, Bárbara AndreaGutiérrez Oliva, SoledadToro Labbé, AlejandroVargas, Rubicelia[Study of antiradical echanisms with dihydroxybenzenes using reaction force and reaction electronic flux]Study of antiradical echanisms with dihydroxybenzenes using reaction force and reaction electronic flux

Muñoz Becerra, KarinaVillegas Escobar, NeryZúñiga Loyola, César AntonioCortés Arriagada, DiegoToro Labbé, Alejandro[Substituent effects on the photophysical properties of amino-aurone-derivatives]Substituent effects on the photophysical properties of amino-aurone-derivatives

Cortés Arriagada, DiegoVillegas Escobar, NeryToro Labbé, AlejandroMiranda Rojas, Sebastián[Adsorption/Desorption process of Formaldehyde onto Iron Doped Graphene : a Theoretical Exploration from Density Functional Theory Calculations.]Adsorption/Desorption process of Formaldehyde onto Iron Doped Graphene : a Theoretical Exploration from Density Functional Theory Calculations.
Cortes, D.Miranda, S.Ortega Ulloa, Daniela ElenaToro Labbé, Alejandro[Oxidized and Si-doped graphene: emerging adsorbents for removal of dioxane]Oxidized and Si-doped graphene: emerging adsorbents for removal of dioxane
Guzmán Angel, Daniela.Inostroza Rivera, RicardoGutiérrez Oliva, SoledadHerrera Pisani, Bárbara AndreaToro Labbé, Alejandro[Role of water in intramolecular proton transfer reactions of formamide and thioformamide]Role of water in intramolecular proton transfer reactions of formamide and thioformamide
Durán, RocíoVöhringer Martínez, EstebanToro Labbé, AlejandroHerrera Pisani, Bárbara Andrea[Reaction electronic flux and its role in DNA intramolecular proton transfers]Reaction electronic flux and its role in DNA intramolecular proton transfers
Villegas Escobar, NeryVogt Geisse, StefanGutiérrez Oliva, SoledadToro Labbé, Alejandro[Symmetry-adapted reaction electronic flux in cycloaddition reactions]Symmetry-adapted reaction electronic flux in cycloaddition reactions
Sáez, David AdriánVogt Geisse, StefanInostroza Rivera, RicardoKubar, TomásElstner, MarcusToro Labbé, AlejandroVöhringer Martínez, Esteban[The effect of the environment on the methyl transfer reaction mechanism between trimethylsulfonium and phenolate]The effect of the environment on the methyl transfer reaction mechanism between trimethylsulfonium and phenolate

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