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Diego Andres Cortés Arriagada

Académico No Regular

Universidad Tecnológica Metropolitana

Santiago, Chile

Líneas de Investigación


Quantum chemistry applied to: i) Co-transport of Pollutants by Micro and Nanoplastics. ii) Adsorption of Pollutants. iii) Intermolecular Interactions in Materials. iv) Electronic and Photophysical Properties of Organometallic Compounds.

Educación

  •  Licenciatura en Educacion Quimica, UNIVERSIDAD METROPOLITANA DE CIENCIAS DE LA EDUCACION. Chile, 2008
  •  Profesor de Quimica y Ciencias Naturales, UNIVERSIDAD METROPOLITANA DE CIENCIAS DE LA EDUCACION. Chile, 2009
  •  Quimica, UNIVERSIDAD DE SANTIAGO DE CHILE. Chile, 2013

Experiencia Académica

  •   Academico Investigador Full Time

    UNIVERSIDAD TECNOLOGICA METROPOLITANA

    Programa Institucional de Fomento a la Investigación, Desarrollo e Innovación (PIDi)

    Santiago, Chile

    2017 - A la fecha

Experiencia Profesional

  •   Docencia Quimica General Part Time

    Pontificia Universidad Católica de Chile

    Chile

    2016 - 2016

  •   Docencia Quimica General Part Time

    Universidad Nacional Andrés Bello

    Santiago, Chile

    2013 - 2013

  •   Asistente Ad-Honorem Fisicoquímica Avanzada - Doctorado en Quimica Part Time

    Pontificia Universidad Católica de Chile

    Santiago, Chile

    2013 - 2016

  •   Profesor de Química y Ciencias Naturales Part Time

    Sociedad Educacional San Alfonzo: Colegio Quitalmahue

    Santiago, Chile

    2008 - 2009

  •   Ayudante Ad-Honorem Fisica III/IV: Electromagnetismo y Física Moderna Part Time

    Universidad Metropolitana de Ciencias de la Educacion

    Santiago, Chile

    2006 - 2007

  •   Academico no Regular Full Time

    Universidad Tecnologica Metropolitana

    Santiago, Chile

    2017 - A la fecha

  •   Postdoctorado Full Time

    Pontificia Universidad Catolica de Chile

    Santiago, Chile

    2013 - 2016

Formación de Capital Humano


2019. Sasha Gazzari Jara. Carrera: Licenciado en Ciencias con mención en Química y Química Industrial. Universidad Tecnológica Metropolitana. Titulo de la Tesis: “Caracterización Teórica de la Interacción de Arsénico (III) sobre Grafeno Dopado con Hierro”. Estado: Grado y titulo obtenidos.



 

Article (101)

Atmospheric microplastics and nanoplastics as vectors of primary air pollutants- A theoretical study on the polyethylene terephthalate (PET) case

Ortega, Daniela E.; Cortes-Arriagada, Diego

Article ISI
ENVIRONMENTAL POLLUTION  (2023)

Deciphering Electronic and Structural Effects in Copper Corrole/Graphene Hybrids

Wrighton-Araneda, Kerry; Cortes-Arriagada, Diego; Dreyse, Paulina; Pascal, Simon; Canard, Gabriel; Sanhueza, Luis

Article ISI
CHEMISTRY-A EUROPEAN JOURNAL  (2023)

Mechanistic insights into the adsorption of endocrine disruptors onto polystyrene microplastics in water

Cortes-Arriagada, Diego; Ortega, Daniela E.; Miranda-Rojas, Sebastian

Article ISI
ENVIRONMENTAL POLLUTION  (2023)

The interaction mechanism of polystyrene microplastics with pharmaceuticals and personal care products

Cortes-Arriagada, Diego; Miranda-Rojas, Sebastian; Camarada, Maria Belen; Ortega, Daniela E.; Alarcon-Palacio, Victoria B.

Article ISI
SCIENCE OF THE TOTAL ENVIRONMENT  (2023)

A first-principles study on the adsorption properties of phosphorene oxide for pollutant removal from water

Cortés-Arriagada, Diego; Daniela E. Ortega

Article ISI, Scopus
JOURNAL OF MOLECULAR LIQUIDS  (2022)

Acetylsalicylic acid interaction with Boron nitride nanostructures-A density functional analysis

Bautista, Maria Corazon Flores; Cortes-Arriagada, Diego; Shakerzadeh, Ehsan; Anota, Ernesto Chigo

Article ISI
JOURNAL OF MOLECULAR LIQUIDS  (2022)

Dependence between luminescence properties of Cu(i) complexes and electronic/structural parameters derived from steric effects

Cortes-Arriagada, Diego

Article ISI, Scopus
NEW JOURNAL OF CHEMISTRY  (2022)

Iron(III)-Light-Induced Homolysis: A Dual Photocatalytic Approach for the Hydroacylation of Alkenes Using Acyl Radicals via Direct HAT from Aldehydes

Chinchole, Anurag; Henriquez, Marco A.; Cortes-Arriagada, Diego; Cabrera, Alan R.; Reiser, Oliver

Article ISI
ACS CATALYSIS  (2022)

Photophysical characteristics of Phenylimidazo(4,5-f)1,10-phenanthroline Rhenium(I) complexes - A theoretical approach to their potential applications in lighting devices

Cortes-Arriagada, Diego

Article ISI, Scopus
MATERIALS SCIENCE IN SEMICONDUCTOR PROCESSING  (2022)

Photophysical characteristics of Phenylimidazo(4,5-f)1,10-phenanthroline Rhenium(I) complexes-A theoretical approach to their potential applications in lighting devices

Gazzari, Sasha; Dreyse, Paulina; Cortes-Arriagada, Diego; Gonzalez, Ivan A.

Article ISI
MATERIALS SCIENCE IN SEMICONDUCTOR PROCESSING  (2022)

Selective detection of Cu2+ ions using a mercaptobenzothiazole disulphide modified carbon paste electrode and bismuth as adjuvant: a theoretical and electrochemical study

Flores-Alvarez, Jose Manuel; Cortes-Arriagada, Diego; Gomez-Sandoval, Zeferino; Jayaprakash, Gururaj Kudur; Ceballos-Magana, Silvia Guillermina; Muniz-Valencia, Roberto; Rojas-Montes, Jaime Cristobal; Pineda-Urbina, Kayim

Article ISI
NEW JOURNAL OF CHEMISTRY  (2022)

Tailoring the arsenic(III) removal ability from water using metal-organic frameworks via metal exchange-A computational study

Ortega, Daniela E.; Cortes-Arriagada, Diego; Garcia-Hernandez, Erwin

Article ISI
JOURNAL OF MOLECULAR LIQUIDS  (2022)

2-Mercaptobenzothiazole modified carbon paste electrode as a novel copper sensor: an electrochemical and computational study

Flores-Alvarez, JM; Cortés-Arriagada, Diego; Reyes-Gomez, J; Gomez-Sandoval, Z; Rojas-Montes, J.C.; Pineda-Urbina, K.

Article ISI, SCOPUS
JOURNAL OF ELECTROANALYTICAL CHEMISTRY  (2021)

A new Cu-II-dinuclear paddlewheel complex. Structural and electronic properties

Karina Seguin, Ana; Wrighton-Araneda, Kerry; Cortes-Arriagada, Diego; Cruz, Carlos; Venegas-Yazigi, Diego; Paredes-Garcia, Veronica

Article ISI
JOURNAL OF MOLECULAR STRUCTURE  (2021)

Acetylsalicylic acid interaction with Boron nitride nanostructures - A density functional analysis

Cortes-Arriagada, Diego

Article ISI, Scopus
JOURNAL OF MOLECULAR LIQUIDS  (2021)

Chiral 1D Metal-Organic Materials Based on Cu(II) and Amino Acid Schiff Bases

Cruz, Carlos; Gonzalez, Carla; Rubio, Francisco; Erices, Juan; Wrighton-Araneda, Kerry; Cortes-Arriagada, Diego; Venegas-Yazigi, Diego; Audebrand, Nathalie; Paredes-Garcia, Veronica

Article ISI
CRYSTAL GROWTH DESIGN  (2021)

Effective removal of water-soluble methylated arsenic contaminants with phosphorene oxide nanoflakes: A DFT study

Wrighton-Araneda, Kerry; Ortega, Daniela E.; Cortes-Arriagada, Diego

Article ISI
JOURNAL OF MOLECULAR LIQUIDS  (2021)

Elucidating the co-transport of bisphenol A with polyethylene terephthalate (PET) nanoplastics: A theoretical study of the adsorption mechanism

Cortes-Arriagada, Diego

Article ISI
ENVIRONMENTAL POLLUTION  (2021)

Enhancing the electrocatalytic activity of Fe phthalocyanines for the oxygen reduction reaction by the presence of axial ligands: Pyridine-functionalized single-walled carbon nanotubes

Paz Oyarzun, Maria; Silva, Nataly; Cortes-Arriagada, Diego; Francisco Silva, Juan; Ponce, Ingrid O.; Flores, Marcos; Tammeveski, Kaido; Belanger, Daniel; Zitolo, Andrea; Jaouen, Frederic; Zagal, Jose H.

Article ISI
ELECTROCHIMICA ACTA  (2021)

Exploring the adsorption properties of doped phosphorene for the uptake of DNA nucleobases in solution

Cortes-Arriagada, Diego; Cid-Mora, Francisca

Article ISI, SCOPUS
JOURNAL OF MOLECULAR LIQUIDS  (2021)

First-principles study of hybrid nanostructures formed by deposited phthalocyanine/porphyrin metal complexes on phosphorene

Cortés-Arriagada, Diego; Miranda-Rojas, Sebastián; Cid-Mora, Francisca; Toro-Labbé, Alejandro

Article ISI
JOURNAL OF MOLECULAR LIQUIDS  (2021)

Fullerene-phosphorene-nanoflake nanostructures: Modulation of their interaction mechanisms and electronic properties through the size of carbon fullerenes

Cortes-Arriagada, Diego; Ortega, Daniela E.

Article ISI
CARBON  (2021)

Fullerene–Phosphorene–nanoflake nanostructures: Modulation of their interaction mechanisms and electronic properties through the size of carbon fullerenes

Cortes-Arriagada, Diego; Ortega, Daniela E.

Article ISI, SCOPUS
CARBON  (2021)

Functionalized porphyrins from meso-poly-halogeno-alkyl-dipyrromethanes: synthesis and characterization

Julliard, Paul-Gabriel; Pascal, Simon; Siri, Olivier; Cortes-Arriagada, Diego; Sanhueza, Luis; Canard, Gabriel

Article ISI
COMPTES RENDUS CHIMIE  (2021)

Functionalized Porphyrins from Meso-poly-halogeno-alkyl-dipyrromethanes: Synthesis and Characterizations

Diego Cortés-Arriagada

Article WOS, ISI, Scopus
COMPTES RENDUS CHIMIE  (2021)

In silico study of the adsorption of acetamiprid on functionalized carbon nanocones

Garcia-Hernandez, E.; Palomino-Asencio, L.; Catarino-Centeno, R.; Nochebuena, J.; Cortes-Arriagada, D.; Chigo-Anota, E.

Article ISI
PHYSICA E-LOW-DIMENSIONAL SYSTEMS NANOSTRUCTURES  (2021)

Intermolecular driving forces on the adsorption of DNA/RNA nucleobases to graphene and phosphorene: An atomistic perspective from DFT calculations

Cortés-Arriagada, Diego

Article ISI, SCOPUS
JOURNAL OF MOLECULAR LIQUIDS  (2021)

Neutral and cationic methallyl nickel complexes in alkene activation: a combined DFT, ESI-MS and chemometric approach

Trofymchuk, Oleksandra S.; Ortega, Daniela E.; Cortes-Arriagada, Diego; Pereira, Alfredo; Daniliuc, Constantin G.; Klitzke, Clecio F.; Santos, Leonardo S.; Rojas, Rene S.

Article ISI
CATALYSIS SCIENCE TECHNOLOGY  (2021)

Removal of water-soluble inorganic arsenicals with phosphorene oxide nanoadsorbents: A first-principles study

Wrighton-Araneda, Kerry; Cortes-Arriagada, Diego

Article ISI
CHEMICAL ENGINEERING JOURNAL  (2021)

A first-principles description of the stability of transition-metal doped phosphorene nanosheets

Gazzari, Sasha; Wrighton-Araneda, Kerry; Cortes-Arriagada, Diego

Article ISI
Surfaces and Interfaces  (2020)

Data of interaction of supported ionic liquids phases onto copper nanoparticles: A density functional theory study

Wrighton-Araneda, Kerry; Valdebenito, Cristian; Abarca, Gabriel; Cortes-Arriagada, Diego

Article ISI
DATA IN BRIEF  (2020)

Effect on the aromaticity of heterocyclic ligands by coordination with ruthenium electron-withdrawing metal centers

Sanhueza, Luis; Cortes-Arriagada, Diego; Diaz, Ramiro; Dreyse, Paulina; Garcia, Camilo; Gonzalez, Ivan A.; Loeb, Barbara

Article ISI
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY  (2020)

Exploring the Nature of Interaction and Stability between Water-Soluble Arsenic Pollutants and Metal-Phosphorene Hybrids: A Density Functional Theory Study

Ortega, Daniela E.; Cortes-Arriagada, Diego

Article ISI
JOURNAL OF PHYSICAL CHEMISTRY A  (2020)

Exploring the Nature of Interaction and Stability between Water-Soluble Arsenic Pollutants and Metal–Phosphorene Hybrids: A Density Functional Theory Study

Ortega, Daniela E.; Cortés-Arriagada, Diego

Article ISI/SCOPUS
The Journal of Physical Chemistry A  (2020)

Highly modulated supported triazolium-based ionic liquids: direct control of the electronic environment on Cu nanoparticles

Valdebenito, Cristián; Pinto, Jose; Nazarkovsky, Michael; Chacón, Gustavo; Martínez-Ferraté, Oriol; Wrighton-Araneda, Kerry; Cortés-Arriagada, Diego; Camarada, María Belén; Alves Fernandes, Jesum; Abarca, Gabriel;

Article WOS-ESCI SCOPUS
NANOSCALE ADVANCES  (2020)

Importance of the interaction adsorbent –adsorbate in the dyes adsorption process and DFT modeling

Aguayo-Villarreal I.A.; Cortes-Arriagada D.; Rojas-Mayorga C.K.; Pineda-Urbina K.; Muñiz-Valencia R.; González J.

Article ISI SCOPUS
 (2020)

Interaction of supported ionic liquids phases onto copper nanoparticles: A DFT study

Wrighton-Araneda, Kerry; Valdevenito, C; Camarada, MarÍa B.; Abarca, Gabriel;; Cortés-Arriagada, Diego

Article ISI/SCOPUS
JOURNAL OF MOLECULAR LIQUIDS  (2020)

Mechanistic study of the competitiveness between branched and linear polyethylene production on N-arylcyano-beta-diketiminate nickel hydride

Ortega, Daniela E.; Cortes-Arriagada, Diego; Trofymchuk, Oleksandra S.; Nachtigall, Fabiane M.; Santos, Leonardo S.; Rojas, Rene S.; Toro-Labbe, Alejandro

Article ISI
POLYMER CHEMISTRY  (2020)

Quantum molecular study on doping effect in titanium and vanadium clusters: their application to remove some chemical species

Hernandez A.B.; Cortés-Arriagada D.; García H.C.; Anota E.C.; Villanueva M.S.

Article ISI SCOPUS
APPLIED NANOSCIENCE  (2020)

Removal of arsenic from water using iron-doped phosphorene nanoadsorbents: A theoretical DFT study with solvent effects

Cortés-Arriagada D.; Ortega D.E.

Article SCOPUS
Journal of Molecular Liquids  (2020)

Studies on the solvatochromic effect and NLO response in new symmetric bimetallic Rhenium compounds

Gonzalez, Ivan; Cortes-Arriagada, Diego; Dreyse, Paulina; Sanhueza, Luis; Crivelli, Irma; Minh Ngo, Hoang; Ledoux-Rak, Isabelle; Toro-Labbe, Alejandro; Maze, Jeronimo; Loeb, Barbara

Article ISI
POLYHEDRON  (2020)

Synthesis and photophysical characterization of novel Ir(III) complexes with a dipyridophenazine analogue (ppdh) as ancillary ligand

Gonzalez, Ivan; Gomez, Josselyn; Santander-Nelli, Mireya; Natali, Mirco; Cortes-Arriagada, Diego; Dreyse, Paulina

Article ISI
POLYHEDRON  (2020)

Uptake of formaldehyde onto doped phosphorene nanosheets: A cluster DFT study of single and co-adsorption states

Gazzari S.; Cortés-Arriagada D.

Article SCOPUS
Journal of alloys  (2020)

Chemical and Physical Viewpoints About the Bonding in Fullerene- Graphene Hybrid Materials: Interaction on Pristine and Fe-Doped Graphene

Cortes-Arriagada, Diego; Sanhueza, Luis; Bautista-Hernandez, Alejandro; Salazar-Villanueva, M.; Anota, Ernesto Chigo

Article ISI SCOPUS
JOURNAL OF PHYSICAL CHEMISTRY C  (2019)

Computational quest of adsorbents based on doped graphene nanosheets for phosgene uptake, and analysis of the co-adsorption phenomena

Mea, Andy; Cortes-Arriagada, Diego

Article ISI SCOPUS
SYNTHETIC METALS  (2019)

Effect of Chemical Order in the Structural Stability and Physicochemical Properties of B12N12 Fullerenes

Escobedo-Morales, Alejandro; Tepech-Carrillo, Lorenzo; Bautista-Hernandez, Alejandro; Humberto Camacho-Garcia, Jose; Cortes-Arriagada, Diego; Chigo-Anota, Ernesto

Article ISI SCOPUS
Scientific Reports  (2019)

Enhancement of caffeine adsorption on boron nitride fullerene by silicon doping

Rosiles Gonzalez, V.; Escobedo-Morales, A.; Cortes-Arriagada, D.; Ruiz Peralta, Ma. de L.; Chigo Anota, E.

Article ISI SCOPUS
APPLIED NANOSCIENCE  (2019)

Fullerene-like boron nitride cages BxNy (x+y=28): stabilities and electronic properties from density functional theory computation

Juarez, AR; Villanueva, MS; Cortes-Arriagada, D; Anota, EC

Article ISI SCOPUS
JOURNAL OF MOLECULAR MODELING  (2019)

Impact of precipitate characteristics and precipitation-conditions on the settling performance of a sulfide precipitation process: An exhaustive characterization of the aggregation behavior

Gim-Krumm, Minghai; Quilaqueo, Michelle; Rojas, Vania; Seriche, Gabriel; Ruby-Figueroa, Rene; Cortes-Arriagada, Diego; Romero, Julio; Troncoso, Elizabeth.; Estay, Humberto.

Article ISI SCOPUS
HYDROMETALLURGY  (2019)

Interaction of H2O with (CuS)(n), (Cu2S)(n), and (ZnS)(n) small clusters (n=1-4, 6): relation to the aggregation characteristics of metal sulfides at aqueous solutions

Wrighton-Araneda, Kerry; Ruby-Figueroa, Rene; Estay, Humberto.; Cortes-Arriagada, Diego

Article ISI SCOPUS
JOURNAL OF MOLECULAR MODELING  (2019)

Interaction of trivalent arsenic on different topologies of Fe-doped graphene nanosheets at water environments: A computational study

Gazzari, Sasha; Cortes-Arriagada, Diego

Article ISI SCOPUS
JOURNAL OF MOLECULAR LIQUIDS  (2019)

Interactions of B12N12 fullerenes on graphene and boron nitride nanosheets: A DFT study

Escobar, JC; Villanueva, MS; Hernandez, AB; Cortes-Arriagada, D; Anota, EC

Article ISI SCOPUS
JOURNAL OF MOLECULAR GRAPHICS MODELLING  (2019)

Molecular conductance versus inductive effects of axial ligands on the electrocatalytic activity of self-assembled iron phthalocyanines: The oxygen reduction reaction

Gutiérrez-Ceron, Cristian; Oñate, Rubén; Zagal, José H.; Pizarro, Ana; Silva, J. Francisco; Castro-Castillo, Carmen; Rezende, Marcos Caroli; Flores, Marcos; Cortés-Arriagada, Diego; Toro-Labbé, Alejandro; Campos, Luis M.; Venkataraman, Latha; Ponce, Ingrid

Article ISI SCOPUS
ELECTROCHIMICA ACTA  (2019)

Performance of doped graphene nanoadsorbents with first-row transition metals (Sc-Zn) for the adsorption of water-soluble trivalent arsenicals: A DFT study

Cortes-Arriagada, Diego; Mella, Andy

Article ISI SCOPUS
JOURNAL OF MOLECULAR LIQUIDS  (2019)

B(C6F5)(3) Promotes the catalytic activation of [N,S]-ferrocenyl nickel complexes in ethylene oligomerization

Rodriguez, B; Cortes-Arriagada, D; Sanchez-Rodriguez, EP; Toscano, RA; Ortega-Alfaro, MC; Lopez-Cortes, JG; Toro-Labbe, A; Rojas, RS

Article ISI SCOPUS
APPLIED CATALYSIS A-GENERAL  (2018)

Building Pyridinium Molecular Wires as Axial Ligands for Tuning the Electrocatalytic Activity of Iron Phthalocyanines for the Oxygen Reduction Reaction

Pizarro, Ana; Abarca, Gabriel;; Gutierrez-Ceron, Cristian; Cortes-Arriagada, Diego; Bernardi, Fabiano; Berrios, Cristhian; Silva, Juan F.; Rezende, Marcos C.; Zagal, Jose H.; Onate, Ruben; Ponce. Ingrid

Article ISI SCOPUS
ACS CATALYSIS  (2018)

Effects on the aromatic character of DNA/RNA nucleobases due to its adsorption onto graphene

Cortés-Arriagada, Diego; Ortega, Daniela E.

Article ISI SCOPUS
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY  (2018)

Fe-doped graphene nanosheet as an adsorption platform of harmful gas molecules (CO, CO2, SO2 and H2S), and the co-adsorption in O-2 environments

Cortés-Arriagada, Diego; Villegas-Escobar, Nery; Ortega, Daniela E.

Article ISI SCOPUS
APPLIED SURFACE SCIENCE  (2018)

Fe-doped graphene nanosheet as an adsorption platform of harmful gas molecules (CO, CO2, SO2 and H2S), and the co-adsorption in O2 environments

Cortés-Arriagada, Diego; Villegas-Escobar, Nery; Ortega, Daniela E.

Article ISI/SCOPUS
APPLIED SURFACE SCIENCE  (2018)

Heteroleptic Cu(I) complexes bearing methoxycarbonyl-imidoylindazole and POP ligands - an experimental and theoretical study of their photophysical properties

Gonzalez, IA; Henriquez, MA; Cortes-Arriagada, D; Natali, M; Daniliuc, CG; Dreyse, P; Maze, J; Rojas, RS; Salas, CO; Cabrera, AR

Article ISI SCOPUS
NEW JOURNAL OF CHEMISTRY  (2018)

Influence of the anion nature and alkyl substituents in the behavior of ionic liquids derived from phenylpyridines

Dreyse, P; Alarcon, A; Galdamez, A; González, I; Cortes-Arriagada, D; Castillo, F; Mella, A

Article ISI SCOPUS
JOURNAL OF MOLECULAR STRUCTURE  (2018)

Insights into the luminescent properties of anionic cyclometalated iridium(III) complexes with ligands derived from natural products

Cortés-Arriagada, Diego; Dreyse, Paulina; Salas, Felipe; González, Iván

Article ISI SCOPUS
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY  (2018)

Mechanistic details of ethylene polymerization reaction using methallyl nickel(ii) catalysts

Ortega, Daniela E.; Cortés-Arriagada, Diego; Toro-Labbé, Alejandro

Article ISI SCOPUS
PHYSICAL CHEMISTRY CHEMICAL PHYSICS  (2018)

Molecular hydrogen formation in the interstellar medium: The role of polycyclic aromatic hydrocarbons analysed by the reaction force and activation strain model

Barrales-Martínez C.; Cortés-Arriagada D.; Gutiérrez-Oliva S.

Article ISI SCOPUS
Monthly Notices of the Royal Astronomical Society  (2018)

Phosphorene as a Template Material for Physisorption of DNA/RNA Nucleobases and Resembling of Base Pairs: A Cluster DFT Study and Comparisons with Graphene

Cortes-Arriagada, Diego

Article ISI SCOPUS
JOURNAL OF PHYSICAL CHEMISTRY C  (2018)

Reaction Electronic Flux Perspective on the Mechanism of the Zimmerman Di-pi-methane Rearrangement

Matute, Ricardo A.; Perez, Patricia; Chamorro, Eduardo; Villegas-Escobar, Nery; Cortes-Arriagada, Diego; Herrera, Barbara; Gutierrez-Oliva, Soledad; Toro-Labbe, Alejandro

Article ISI SCOPUS
JOURNAL OF ORGANIC CHEMISTRY  (2018)

Substituent effects on the photophysical properties of amino-aurone-derivatives

Muñoz-Becerra K.; Villegas-Escobar N.; Zúñiga-Loyola C.; Cortés-Arriagada D.; Toro-Labbé A.

Article ISI SCOPUS
MOLECULAR PHYSICS  (2018)

A DFT analysis of the adsorption of nitrogen oxides on Fe-doped graphene, and the electric field induced desorption

Cortés-Arriagada D.; Villegas-Escobar N.

Article ISI SCOPUS
APPLIED SURFACE SCIENCE  (2017)

Adsorption of polycyclic aromatic hydrocarbons onto graphyne: Comparisons with graphene

Cortés-Arriagada D.

Article ISI SCOPUS
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY  (2017)

Adsorption/desorption process of formaldehyde onto iron doped graphene: a theoretical exploration from density functional theory calculations

Cortés-Arriagada, Diego; Villegas-Escobar, Nery; Miranda-Rojas, Sebastián; Toro-Labbé, Alejandro

Article ISI SCOPUS
PHYSICAL CHEMISTRY CHEMICAL PHYSICS  (2017)

Fluorescence properties of aurone derivatives: an experimental and theoretical study with some preliminary biological applications

Espinosa-Bustos, Christian; Cortés-Arriagada, Diego; Soto-Arriaza, Marco A.; Robinson-Duggon, José; Pizarro, Nancy; Cabrera, Alan R.; Fuentealba, Denis; Salas, Cristian O.

Article ISI SCOPUS
PHOTOCHEMICAL PHOTOBIOLOGICAL SCIENCES  (2017)

In silico characterization of nitric oxide adsorption on a magnetic [B24N36 fullerene/(TiO2)(2)](-) nanocomposite

Anota E.C.; Arriagada D.C.; Hernández A.B.; Castro M.

Article ISI SCOPUS
APPLIED SURFACE SCIENCE  (2017)

Nonlinear optical response of octupolar Zn(II) complexes incorporating highly aromatic polypyridinic ligands: Insights into the role of the metal center

Sanhueza, L; Cortes-Arriagada, D; Ledoux-Rak, I; Crivelli, I; Loeb, B

Article ISI SCOPUS
Synthetic Metals  (2017)

Oxidized and Si-doped graphene: emerging adsorbents for removal of dioxane

Cortés-Arriagada, Diego; Miranda-Rojas, Sebastián; Ortega, Daniela E.; Toro-Labbé, Alejandro

Article ISI SCOPUS
PHYSICAL CHEMISTRY CHEMICAL PHYSICS  (2017)

Supramolecular Reversible On-Off Switch for Singlet Oxygen Using Cucurbit[n]uril Inclusion Complexes

Robinson-Duggon, José; Pérez-Mora, Francisco; Valverde-Vásquez, Liliana; Cortés-Arriagada, Diego; De la Fuente, Julio Ramón; Günther, Germán; Fuentealba, Denis

Article SCOPUS
Journal of Physical Chemistry C  (2017)

Supramolecular Reversible On-Off Switch for Singlet Oxygen Using Cucurbit[n]uril Inclusion Complexes

Robinson-Duggon, J; Perez-Mora, F; Valverde-Vasquez, L; Cortes-Arriagada, D; De la Fuente, JR; Gunther, G; Fuentealba, D

Article
JOURNAL OF PHYSICAL CHEMISTRY C  (2017)

Tailoring electroactive surfaces by non-template molecular assembly. Towards electrooxidation of L-cysteine

Santander-Nelli M.; Silva C.P.; Espinoza-Vergara J.; Silva J.F.; Olguín C.F.; Cortés-Arriagada D.; Zagal J.H.; Mendizabal F.; Díez-Pérez I.; Pavez J.

Article ISI SCOPUS
ELECTROCHIMICA ACTA  (2017)

The Role of Co-Activation and Ligand Functionalization in Neutral Methallyl Nickel(II) Catalysts for Ethylene Oligomerization and Polymerization

Ortega, Daniela E.; Cortés-Arriagada, Diego; Trofymchuk, Oleksandra S.; Yepes, Diana; Gutiérrez-Oliva, Soledad; Rojas, René S.; Toro-Labbé, Alejandro

Article ISI SCOPUS
CHEMISTRY-A EUROPEAN JOURNAL  (2017)

Theoretical analysis of C-F bond cleavage mediated by cob[I]alamin-based structures

Cortés-Arriagada, D.; Toro-Labbe, A.; Mora, J. R.; Rincón, L.; Mereau, R.; Torres, F. J.

Article ISI SCOPUS
JOURNAL OF MOLECULAR MODELING  (2017)

Why Low Valent Lead(II) Hydride Complex Would be a Better Catalyst for CO2 Activation than Its 14 Group Analogues?

Villegas-Escobar, Nery; Ortega, Daniela E.; Cortés-Arriagada, Diego; Durán, Rocío; Yepes, Diana; Gutiérrez-Oliva, Soledad; Toro-Labbé, Alejandro

Article ISI SCOPUS
JOURNAL OF PHYSICAL CHEMISTRY C  (2017)

A theoretical investigation of the removal of methylated arsenic pollutants with silicon doped graphene

Cortés-Arriagada D.; Toro-Labbe, A.

Article ISI SCOPUS
JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING  (2016)

About the electronic and photophysical properties of iridium(III)-pyrazino[2,3-f][1,10]-phenanthroline based complexes for use in electroluminescent devices

Cortes-Arriagada, D; Sanhueza, L.; Gonzalez, I; Dreyse, P; Toro-Labbe, A

Article ISI SCOPUS
PHYSICAL CHEMISTRY CHEMICAL PHYSICS  (2016)

Aluminum and iron doped graphene for adsorption of methylated arsenic pollutants

Cortés-Arriagada, Diego; Toro-Labbé, Alejandro

Article ISI SCOPUS
APPLIED SURFACE SCIENCE  (2016)

Expanding the environmental applications of metal (Al, Ti, Mn, Fe) doped graphene: adsorption and removal of 1,4-dioxane

Cortés-Arriagada, Diego

Article ISI
PHYSICAL CHEMISTRY CHEMICAL PHYSICS  (2016)

Insights into the use of Au19Cu and Au19Pd clusters for adsorption of trivalent arsenic

Cortés-Arriagada D.; Toro-Labbe, A.

Article ISI SCOPUS
Theoretical Chemistry Accounts  (2016)

New cyclometalated Ir( III ) complexes with bulky ligands with potential applications in LEC devices: experimental and theoretical studies of their photophysical properties

Dreyse, Paulina; Gonzalez, Ivan; Cortes-Arriagada, Diego; Ramirez, Oscar; Salas, Ignacio; Gonzalez, Andrea; Toro-Labbe, Alejandro; Loeb, Barbara

Article ISI SCOPUS
NEW JOURNAL OF CHEMISTRY  (2016)

Synthesis of new phosphorescent imidoyl-indazol and phosphine mixed ligand Cu(I) complexes structural characterization and photophysical properties

Cabrera, AR; Gonzalez, IA; Cortes-Arriagada, D; Natali, M; Berke, H; Daniliuc, CG; Camarada, MB; Toro-Labbe, A; Rojas, RS; Salas, CO

Article ISI SCOPUS
RSC Advances  (2016)

The effect of pH on the adsorption of arsenic(III) and arsenic(V) at the TiO2 anatase [101] surface

Wei, ZG; Liang, K; Wu, Y; Zou, YD; Zuo, JH; Arriagada, DC; Pan, ZC; Hu, GH

Article ISI SCOPUS
JOURNAL OF COLLOID AND INTERFACE SCIENCE  (2016)

A comparative study of Ir(III) complexes with pyrazino[2,3-f][1,10]phenanthroline and pyrazino[2,3-f][4,7]phenanthroline ligands in light-emitting electrochemical cells (LECs)

Gonzalez, I; Dreyse, P; Cortes-Arriagada, D; Sundararajan M.; Morgado C.; Brito, I; Roldan-Carmona, C; Bolink, HJ; Loeb, B

Article ISI SCOPUS
DALTON TRANSACTIONS  (2015)

A Family of Ir-III Complexes with High Nonlinear Optical Response and Their Potential Use in Light-Emitting Devices

Gonzalez, I; Cortes-Arriagada, D; Dreyse, P; Sanhueza-Vega, L; Ledoux-Rak, I; Andrade, D; Brito, I; Toro-Labbe, A; Soto-Arriaza, M; Caramori, S; Loeb, B

Article ISI SCOPUS
European Journal of Inorganic Chemistry  (2015)

Binding of Trivalent Arsenic onto the Tetrahedral Au-20 and Au19Pt Clusters: Implications in Adsorption and Sensing

Cortes-Arriagada, D; Oyarzun, MP; Sanhueza, L.; Toro-Labbe, A

Article ISI SCOPUS
Journal of Physical Chemistry A  (2015)

Improving As(III) adsorption on graphene based surfaces: impact of chemical doping

Cortes-Arriagada, D; Toro-Labbe, A

Article ISI SCOPUS
Physical Chemistry Chemical Physics  (2015)

Evaluating the hydrogen chemisorption and physisorption energies for nitrogen-containing single-walled carbon nanotubes with different chiralities: a density functional theory study

Contreras, ML; Cortes-Arriagada, D; Villarroel, I; Alvarez J.; Rozas, R

Article ISI SCOPUS
STRUCTURAL CHEMISTRY  (2014)

The mechanism of chemisorption of hydrogen atom on graphene: Insights from the reaction force and reaction electronic flux

Cortes-Arriagada, D; Gutierrez-Oliva, S; Herrera, B.; Soto K.; Toro-Labbe, A

Article ISI SCOPUS
JOURNAL OF CHEMICAL PHYSICS  (2014)

Electron Transport Properties through Graphene Oxide-Cobalt Phthalocyanine Complexes

Cardenas-Jiron, GI; Leon-Plata, P; Cortes-Arriagada, D; Seminario, JM

Article ISI SCOPUS
JOURNAL OF PHYSICAL CHEMISTRY C  (2013)

Global and local reactivity indexes applied to understand the chemistry of graphene oxide and doped graphene

Arriagada, DC

Article ISI SCOPUS
JOURNAL OF MOLECULAR MODELING  (2013)

Modeling the physisorption of bisphenol A on graphene and graphene oxide

Cortes-Arriagada, D; Sanhueza, L.; Santander-Nelli, M

Article ISI SCOPUS
JOURNAL OF MOLECULAR MODELING  (2013)

Removal of 4-chlorophenol using graphene, graphene oxide, and a-doped graphene (A = N, B): A computational study

Arriagada, DC; Sanhueza, L.; Wrighton, K

Article ISI SCOPUS
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY  (2013)

A through-space charge transfer mechanism for explaining the oxidation of 2-chlorophenol on a tetrasulphonated nickel(III) phthalocyanine

Cortes-Arriagada, D; Cardenas-Jiron, GI

Article ISI SCOPUS
COMPUTATIONAL AND THEORETICAL CHEMISTRY  (2011)

Electrical Characteristics of Cobalt Phthalocyanine Complexes Adsorbed on Graphene

Cardenas-Jiron, GI; Leon-Plata, P; Cortes-Arriagada, D; Seminario, JM

Article ISI SCOPUS
JOURNAL OF PHYSICAL CHEMISTRY C  (2011)

High Stability and Properties of Adsorbed Polycyclic Aromatic Hydrocarbons (PAHs) onto Phosphorene: An atomistic DFT study

Cortes-Arriagada, Diego

Article ISI, Scopus
JOURNAL OF MOLECULAR LIQUIDS  

BookSection (1)

Condensation Reaction between Phenanthroline-5,6-diones and Ethylenediamine and Its Optimization through Dialogue between Theory and Experiment

Sanhueza, Luis; Cortés-Arriagada, Diego; Gonzales, Ivan; Loeb, Barbara; H. N. Cheng

BookSection
 (2017)

Proyecto (11)

A comprehensive scale of interaction mechanisms and stabilities between nanoplastics and water pollutants: Explaining the co-transport properties of nanoplastics using computational chemistry

Cortés-Arriagada, Diego

Proyecto
 (2021)

Clúster de Computación Acelerada por GPU

UNIVERSIDAD TECNOLOGICA METROPOLITANA (L318-04)

Proyecto
2019-2020
Inv. Responsable

Clúster Supermicro para Cómputo Científico

FONDEQUIP (EQM180180)

Proyecto
2018-2020
Inv. Responsable

Red Internacional para el estudio de sistemas híbridos Grafeno-Fullereno

PCI (REDI170303)

Proyecto
2017-2019
Inv. Responsable

Theoretical characterization of the interaction of Arsenic onto low-dimensional materials=> Implications in adsorption of pollutants

FONDECYT (11170289)

Proyecto
2017-2020
Inv. Responsable

ADSORCION DE CONTAMINANTES SOBRE GRAFENO=> ESTUDIO TEORICO DE LOS MODOS Y MECANISMOS DE INTERACCION, Y OPTIMIZACION DEL PROCESO DE ADSORCION.

FONDECYT (3140314)

Proyecto
2013-2016
Inv. Responsable

Núcleo Milenio Chemical Processes and Catalysis 120082

Iniciativa Cientifica Milenio (120082)

Proyecto
2013-2016
Postdoctorado

Síntesis de complejos organometálicos de Iridio para su utilización en celdas electroquímicas emisoras de luz, mejoras utilizando líquidos iónicos y nano partículas

FONDECYT (11130221)

Proyecto
2013-2016
Personal técnico y/o de apoyo

TOWARD A THEORY OF CHEMICAL REACTIONS AND REACTION DYNAMICS

FONDECYT (1130072)

Proyecto
2013-2017
Personal técnico y/o de apoyo

Theoretical Study of the Porphyrin Binding Nature in Supramolecular Assemblies

FONDECYT (1090700)

Proyecto
2009-2012
Tesista

Theoretical Study of the Structural and Electronic Chemistry of Porphyrins

FONDECYT (1060203)

Proyecto
2006-2008
Tesista

102
Diego Cortés

Académico No Regular

Programa Institucional de Fomento a la Investigación, Desarrollo e Innovación

Universidad Tecnológica Metropolitana

Santiago, Chile

14
Daniela Ortega

Profesora Asistente

Ciencias Químicas y Bíologicas

Universidad Bernardo O'Higgins

Santiago, Chile

14
Alejandro Toro

PROFESOR TITULAR

Química Física

PONTIFICIA UNIVERSIDAD CATOLICA DE CHILE

Santiago, Chile

11
Iván González

Profesor

Química

Universidad Tecnológica Metropolitana

Santiago, Chile

10
Paulina Dreyse

Profesor Asistente

Departamento de Química

Universidad de Chile

Santiago, Chile

9
LUIS SANHUEZA

Profesor part time química analítica

Universidad católica de temuco

SANTIAGO, Chile

9
Kerry Wrighton

Postdoctoral research

Programa Institucional de fomento a la I+D+i

Universidad Tecnológica Metropolitana

Santiago, Chile

6
Nery Villegas

Profesor Asistente

Universidad de Concepción

Universidad de Concepción

Concepción, Chile

4
Luis Sanhueza

Profesor

Universidad Católica de Temuco

Temuco, Chile

4
Rene Rojas

Professor

Chemistry

PONTIFICIA UNIVERSIDAD CATOLICA DE CHILE

Santiago, Chile

3
Oleksandra Trofymchuk

assistant professor

Universidad de Chile

Santaigo, Chile

3
Cristhian Berríos

Académico

Ciencias del Ambiente

UNIVERSIDAD DE SANTIAGO DE CHILE

Santiago, Chile

3
Maria Soledad Gutiérrez

Profesor Asociado

Química-Física

PONTIFICIA UNIVERSIDAD CATOLICA DE CHILE

Santiago, Chile

2
Cristian Salas

Associate professor

Organic Chemistry

PONTIFICIA UNIVERSIDAD CATOLICA DE CHILE

Santiago, Chile

2
Ivan Brito

Full Professor

Chemsitry

UNIVERSIDAD DE ANTOFAGASTA

Antofagasta, Chile

2
Verónica Paredes

Academic

Ciencias Químicas

UNIVERSIDAD ANDRES BELLO

Santiago, Chile

2
Ivan Brito

Profesor Titular

Quimica

Universidad de Antofagasta

Antofagasta, Chile

2
Alan Cabrera

Profesor Asistente

Departamento de Química Inorganica

Pontificia Universidad Católica de Chile

Santiago, Chile

2
Bárbara Herrera

Profesor Asociado

PONTIFICIA UNIVERSIDAD CATÓLICA DE CHILE

Santiago, Chile

2
LEONARDO SILVA

PROFESOR TITULAR

UNIVERSIDAD DE TALCA

TALCA, Chile

2
Diego Venegas

Full Professor

Quimica de los Materiales

UNIVERSIDAD DE SANTIAGO DE CHILE, FACULTAD DE QUÍMICA Y BIOLOGÍA, DEPARTAMENTO DE QUÍMICA DE LOS MATERIALES

Santiago, Chile

2
Marcos Flores

profesor asociado

departamento de física

UChile

santiago, Chile

2
Gabriel Abarca

Profesor Asociado

Departamento de Ciencias Químicas y Biológicas

Universidad Bernardo O'Higgins

Santiago, Chile

2
René Ruby

Researcher

UNIVERSIDAD TECNOLOGICA METROPOLITANA

San Joaquín, Chile

2
Humberto Estay

Investigador Principal

AMTC

Universidad de Chile

Santiago, Chile

2
Mireya Santander

Asistente de Investigación

Química

Universidad Técnica Federico Santa María

Santiago, Chile

2
Patricia Perez

Full Professor

Ciencias Químicas

UNIVERSIDAD ANDRÉS BELLO

Santiago, Chile

2
José Zagal

Distinguished Professor

Chemistry of Materials

UNIVERSIDAD DE SANTIAGO DE CHILE

Santiago, Chile

2
Sebastián Miranda

Profesor Asistente

Departamento de Ciencias Químicas

UNIVERSIDAD NACIONAL ANDRES BELLO

Santiago, Chile

1
Alfredo Pereira

Profesor Asistente

Universidad San Sebastián

Santiago, Chile

1
Nataly Silva

Profesor Investigador Asociado Regular

Facultad de Diseño

Universidad del Desarrollo

Santiago, Chile

1
Vania Rojas

Investigador asociado

Advanced Mining Technology Center (AMTC), Universidad de Chile

santiago, Chile

1
Denis Fuentealba

PROFESOR ASOCIADO

QUIMICA FISICA

PONTIFICIA UNIVERSIDAD CATÓLICA DE CHILE

Santiago, Chile

1
Jeronimo Maze

Associate Professor

Physics

FACULTAD DE FISICA, PONTIFICIA UNIVERSIDAD CATOLICA

Santiago, Chile

1
Cristian Gutiérrez

Investigador de Postdoctorado

Departemento Química de los Materiales

Universidad de Santiago de Chile

Santiago, Chile

1
Ricardo Matute

Associate Professor

Centro Integrativo de Biología y Química Aplicada (CIBQA)

Universidad Bernardo O'Higgins

Santiago , Chile

1
EDUARDO CHAMORRO

Director CENTRO DE QUIMICA TEÓRICA & COMPUTACIONAL (CQT&C)

Departamento de Ciencias Químicas

UNIVERSIDAD ANDRES BELLO

Santiago, Chile

1
Julio Romero

Associate Professor

Departamento de Ingeniería Química y Bioprocesos

UNIVERSIDAD DE SANTIAGO DE CHILE

Santiago, Chile

1
Francisco Castillo

Instructor Adjunto

Química Orgánica

Pontificia Universidad Católica de Chile

Santiago, Chile

1
Rocío Durán

Investigadora Asistente

Universidad de Talca

Talca, Chile

1
Karina Muñoz

Académica Investigadora

Centro Integrativo de Biología y Química Aplicada - CIBQA

Universidad Bernardo O'Higgins

Santiago, Chile

1
Bárbara Rodríguez

Académica/Investigadora

Centro de Investigación en Recursos Naturales y Sustentabilidad

Universidad Bernardo O'Higgins

Santiago, Chile

1
Juan Silva

Academic

Química de los Materiales

UNIVERSIDAD DE SANTIAGO DE CHILE

Santiago, Chile

1
Michelle Quilaqueo

Ingeniera de Investigación

AMTC

Universidad de Chile

Santiago, Chile

1
María Camarada

Director/Profesor Asistente

Centro de Nanotecnología Aplicada

Universidad Mayor

Santiago, Chile

1
Gabriel Seriche

Investigador

Advanced Mining Technology Center (AMTC)

Universidad de Chile

Santiago, Chile

1
Cristian Valdebenito

Investigador Asistente

Centro Integrativo de Biología y Química Aplicada

Universidad Bernardo O'Higgins

Santiago, Chile

1
Marco Soto

Profesor Asociado

Química Física

Pontificia Universidad Católica de Chile

Santiago, Chile

1
César Zúñiga

Postdoctoral Researcher

Materials Chemistry

Universidad de Santiago de Chile

Santiago, Chile

1
Fabiane Manke

Académico Docente Investigador

Universidad Autónoma de Chile

Talca, Chile

1
César Barrales

Postdoctoral researcher

Universidad de Chile

Santiago, Chile

1
Elizabeth Troncoso

Profesora Asociada

Departamento de Química

Universidad Tecnológica Metropolitana

Santiago, Chile