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Dr. Gloria Cárdenas
Molecular junction system composed of Au(111)-Dyad 6-Au(111). Both electrodes (yellow balls) extend to infinity in the transport direction z. Electronic absorption spectra of the D1-D6 dyads calculated at the 6-311G(d,p) level of theory in the solution phase (CH2Cl2).
Teacher of Chemistry from the UMCE, Master in Chemical Sciences and PhD. in Sciences Mention in Chemistry, both from the Universidad de Chile, and Post-Doctoral in Theoretical Chemistry from the Pontificia Universidad Catolica de Chile.
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2021 Project DICYT Postdoctorate USACH-CHILE, Theoretical characterization of advanced oxidation processes. oxidation mechanism of textile dyes and properties of modified catalysts based on titanium dioxide. Position: Responsible Researcher, PostDoc Researcher: Dr. Ricardo Pino-Rios.
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2021-2023 Project FONDECYT Postdoctorate ANID-CHILE, Theoretical-computational design of molecular spintronic devices, based on metalated porphyrins and phthalocyanines. Responsible Researcher: Dr. Nicolas Montenegro Pohlhammer. Position: Sponsoring Researcher.
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2020-2023 Project ECOS/ANID 2019 C19E03, Development of Near-Infrared Light Collectors based on Phthalocyanine for Dye-Sensitized Solar Cells and Solar Driven Hydrogen Production. Chilean Responsible Researcher: Dr. Gloria Cárdenas-Jirón, French Responsible Researcher: Dr. Fabrice Odobel.
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2020 Project DICYT Postdoctorate N° 022041CJ, USACH-CHILE, Design of Dyes based in Expanded Porphyrins with Potential Applications in Solar Cells DSSC. Position: Responsible Researcher, PostDoc Researcher: Dr. Merlys Borges Martinez.
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2019-2021 Project FONDECYT Regular N° 1191561, CONICYT-CHILE, Hydrogenolysis and Catalytic Oxidation of Organosolv Lignin in Acidic Ionic Liquids: Selective Production of Aromatic Chemicals of Industrial Interest. Responsible Researcher: Dr. Mauricio Yañez. Co-Responsible Researcher: Dr. Gloria Cárdenas-Jirón.
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2019 Project USA1799 VRIDEI 021941GC_GO Universidad de Santiago de Chile, Theoretical Study of the Electron Transfer Process in Assemblies of Porphyrin-Chromophore-TiO2 as Potential System for Dye-Sensitized Solar Cells (DSSC). Position: Responsible Researcher, PostDoc Researcher: Dr. Merlys Borges Martinez.
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2019 Project DICYT Postdoctorate N° 021941CJ, USACH-CHILE, Quantum Chemical Study of Spintronics and Molecular Electronics Applied to Expanded Porphyrins and Metalled Phthalocyanines. Position: Responsible Researcher, PostDoc Researcher: Dr. Nicolás Montenegro Pohlhammer.
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2019 Project DICYT Postdoctorate N° 021941CJ, USACH-CHILE, Theoretical Study of the Perovskite-TiO2 Junction Stability in APbX3 Perovskite Crystals with MA+, FA+ and AVA+ (A) Anions and Cl-, Br- and I- (X) Halides. Position: Responsible Researcher, PostDoc Researcher: Dr. Rodrigo Urzúa Leiva.
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2018 Project Fortalecimiento N° USA1799_CG241216, USACH-CHILE, Theoretical Modelling of Dye Sensitized Solar Cells based in Porphyrin/Expanded Porphyrin and Titanium Dioxide. Position: Responsible Researcher, Research Assistant : Dr. Rodrigo Urzúa Leiva
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2018 Project DICYT Postdoctorate N° 021841CJ, USACH-CHILE, Theoretical Study of the Magnetic and Electron Transport Properties in Porphyrins and Metal Phthalocyanines with Potential Applications in Spintronics and Molecular Electronics. Position: Responsible Researcher, PostDoc Researcher: Dr. Nicolás Montenegro Pohlhammer.
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2018-2020 Project FONDECYT Postdoctorate N° 3180119, CONICYT-CHILE, Computational Rational Design of Expanded Porphyrins as Potential Light Collectors for Application in Dyes Sensitized Solar Cells Supported on Titanium Oxide (TiO2). Responsible Researcher: Dr. Ricardo Pino Ríos. Position: Sponsoring Researcher
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2017-2020 Project FONDECYT Regular N° 1171719, CONICYT-CHILE, Visible Light Photosensitizers based in Porphyrins and Expanded Derivatives for Dye Sensitized Solar Cells Consisting of Titanium Dioxide, Graphene and Fullerene as Semiconductors. Position: Responsible Researcher
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2016-2018 Project of Insertion of Advanced Human Capital in the Academy Nº 79150043, CONICYT-CHILE, Surface Chemistry based in Titanium Dioxide and Metal Carbides with Applications in Solar Cells and Heterogeneous Catalysis. Position: Responsible Researcher. Insertion Researcher: Dr. Raúl Mera Adasme
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2013-2016 Project FONDECYT Regular N° 1131002, CONICYT-CHILE, Theoretical Assessment of the Photosensitization of Porphyrins Anchored on Titanium Dioxide and Organic Supports. Position: Responsible Researcher
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2011-2013 Project of Insertion of Advanced Human Capital in the Academy Nº 79100010, CONICYT-CHILE, Strengthening the areas of organic chemistry and polymers in teaching and research. Position: Responsible Researcher. Insertion Researchers: Dra. Paula Zapata Ramirez, Dr. Mauricio Yañez Sánchez
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2009-2012 Project FONDECYT Regular Nº 1090700 CONICYT-CHILE, Theoretical Study of the Porphyrin Binding Nature in Supramolecular Assemblies.Position: Responsible Researcher
97.- "A Photo-Induced Spin Crossover based Molecular Switch and Spin Filter Operating at Room Temperature", Nicolas Montenegro-Pohlhammer, Rocio Sanchez-de-Armas, Carmen J. Calzado, Merlys Borges-Martinez, Gloria Cárdenas-Jirón, Dalton Transactions, (2021), accepted. DOI: 10.1039/D1DT00078K
96.- "The Bimetallic and the Anchoring Group Effects on both the Optical and Charge Transport Properties of Hexaphyrin Amethyrin", Merlys Borges-Martinez, Nicolas Montenegro-Pohlhammer, Gloria Cárdenas-Jirón, New Journal of Chemistry, 45 (2021), 6521-6534. DOI: 10.1039/D1NJ00091H
95.- "Assessment of New Expanded Phorpholactones as UV/VIS/NIR chromophores for Dye-Sensitized Solar Cells applications", Ricardo Pino-Rios, Nicolas Montenegro-Pohlhammer, Gloria Cárdenas-Jirón, Journal of Physical Chemistry A, 125 (2021), 2267-2275. DOI: 10.1021/acs.jpca.0c11188
94.- "Insight into effects of the anchoring groups on the photovoltaic performance of unsymmetrical phthalocyanine based dye-sensitized solar cells", Gülenay Tunç, Michael Zambrano-Angulo, Barış Seçkin Arslan, Emre Güzel, Mehmet Nebioğlu, Vefa Ahsen, İlkay Şişman, Gloria Cárdenas-Jirón, Ayşe Gül Gürek, Dalton Transactions, 50 (2021) 2981-2996. DOI:10.1039/D0DT03696J
93.- “Local and Macrocyclic (Anti)Aromaticity of Porphyrinoids Revealed by the Topology of the Induced Magnetic Field", Ricardo Pino-Rios, Gloria Cárdenas-Jirón, William Tiznado, Physical Chemistry Chemical Physics, 22 (2020) 21267-21274. DOI: 10.1039/D0CP03272G.
92.- “Effects of the methylammonium ion substitutions by 5-ammoniumvaleric acid in lead trihalide perovskite solar cell: A combined experimental and theoretical investigation", Rodrigo Urzúa-Leiva, Amir Narymany Shandy, Haibing Xie, Mónica Lira-Cantú, Gloria Cárdenas-Jirón, New Journal of Chemistry 44 (2020) 14642-14649. DOI: 10.1039/D0NJ02748K.
91.- “Influence of cyano substituents on the electron density and catalytic activity towards the oxygen reduction reaction for iron phthalocyanine. The case for Fe(II) 2,3,9,10,16,17,23,24-octa(cyano)phthalocyanine”, Joseph Govan, Gabriel Abarca, Carolina Aliaga, Byran Sanhueza, Walter Orellana, Gloria Cárdenas-Jirón, José H. Zagal, Federico Tasca, Electrochemistry Communications 118 (2020), 106784. DOI: 10.1016/j.elecom.2020.106784.
90.- "Zn(II)-Porphyrin-Squaraine Dyads as Potential Components for Dye-Sensitized Solar Cells: A Quantum Chemical Study of Optical and Charge Transport Properties", Merlys Borges-Martinez, Nicolas Montenegro-Pohlhammer, Yoh Yamamoto, Tunna Baruah, Gloria Cárdenas-Jiron, Journal of Physical Chemistry C 124 (2020), 12968-12981. DOI: 10.1021/acs.jpcc.0c02865.
89.- "The Boron Nitride (B116N124) Fullerene: Stability and Electronic Properties from DFT Simulations", Alejandro Rodriguez Juarez, Filiberto Ortiz Chi, Ricardo Pino Rios, Gloria Cárdenas-Jirón, Martin Salazar Villanueva, Ernesto Chigo Anota, Chemical Physics Letters 741 (2020), 137097-137104. DOI: 10.1016/j.cplett.2020.137097.
88.- "B12N12 Cluster as a Collector of Noble Gases: A Quantum Chemical Study", Ricardo Pino-Rios, Ernesto Chigo-Anota, Ehsan Shakerzadeh, Gloria Cárdenas-Jirón, Physica E: Low-Dimensional Systems and Nanostructures, 115 (2020) 113697 (1-6). DOI: 10.1016/physe.2019.113697
87.- "Orbital Weighted Dual Descriptor for the Study of Local Reactivity of Systems with Quasi-Degenerate States", Ricardo Pino-Rios, Diego Inostroza, Gloria Cárdenas-Jirón, William Tiznado, Journal of Physical Chemistry A, 123 (2019) 10556-10562. DOI: 10.1021/acs.jpca.9b07516
86.- "Elucidating the Electronic Structure and Magnetic and Conducting Properties of μ-oxo Mn-phthalocyanine [MnPc(CN)]2O Complex", Nicolas Montenegro-Pohlhammer, Rocío Sánchez-de-Armas, Gloria Cárdenas-Jirón, Carmen J Calzado, Journal of Physical Chemistry C , 123 (2019) 28359-28369. DOI: 10.1021/acs.jpcc.9b08046
85.-"Effect of the Meso/Beta Halogenation in the Photoelectronic Properties and Aromaticity of Expanded Porphyrins", Ricardo Pino-Rios, Gloria Cárdenas-Jirón, Journal of Photochemistry and Photobiology A: Chemistry, 385 (2019) 112052-112057. DOI: 10.1016/j.jphotochem.2019.112052
84.- "Effect of New Asymmetrical Zn(II) Phthalocyanines on the Photovoltaic Performances of Dye-Sensitized Solar Cell", Gülenay Tunç, Emre Güzel, İlkay Şişman, Vefa Ahsen, Gloria Cárdenas-Jirón, Ayse Gul Gurek, New Journal of Chemistry, 43 (2019) 14390-14401. DOI: 10.1039/c9nj02585e.
83.- "Assessment of BODIPY-Oxasmaragdyrin Dyads for Dye Sensitized Solar Cells: Aromaticity, Photosensitization Capability and Charge Transport", Merlys Borges-Martínez, Daniel Alvarez, Nicolas Montenegro-Pohlhammer, María Isabel Menéndez, Ramón López, Gloria Cárdenas-Jirón, Journal of Physical Chemistry C, 123 (2019) 19362-19375. DOI: 10.1021/acs.jpcc.9b05136.
82.- "Spin-Filter Transport and Magnetics Properties in Binuclear Cu(II) Expanded Porphyrin Based Molecular Junction", Nicolas Montenegro-Pohlhammer, Rodrigo Urzúa-Leiva, Dayán Páez-Hernández, Gloria Cárdenas-Jirón, Dalton Transactions, 48 (2019) 8418-8426. DOI: 10.1039/C9DT01312A
81.- "Stability, Electronic and Optical Properties of the Boron Nitride Cage (B47N53) from Quantum Mechanical Calculations", A. Rodriguez Juarez, F. Ortiz-Chi, M. Borges-Martinez, G. Cárdenas-Jirón, M. Salazar Villanueva, E. Chigo Anota, Physica E: Low-dimensional Systems and Nanostructures, 111 (2019) 118-126.
80.- "Interpreting Aromaticity and Antiaromaticity through Bifurcation Analysis of the Induced Magnetic Field", Ricardo Pino-Rios, Gloria Cárdenas-Jirón, Lina Ruiz, William Tiznado, Chemistry Open, 8 (2019) 321-326.
79.- "The Influence of Antenna and Anchoring Moieties on the Improvement of Photoelectronic Properties in Zn(II)-Porphyrin-TiO2 and Potential Dye-Sensitized Solar Cells”, Rodrigo Urzúa-Leiva, Ricardo Pino-Rios, Gloria Cárdenas-Jirón, Physical Chemistry Chemical Physics, 21 (2019) 4339-4348.
78.- "Quantum Chemical Studies of Porphyrin- and Expanded Porphyrin-based Systems and Their Potential Applications on Nanoscience. Latin American Research Review”, Gloria Cárdenas-Jirón, Merlys Borges-Martínez, Raúl Mera-Adasme, Ricardo Pino-Ríos, International Journal of Quantum Chemistry, 119 (2019) e25821-25835. DOI:10.1002/qua.25821.
77.- "Theoretical Rationalisation of the Photophysics of TICT Excited State of Cinnamoyl-Coumarin Derivatives in Homogeneous and Biological Membrane Models”, Daniel Zúñiga-Núñez, Ricardo A. Zamora, Pablo Barrías, Cristian Andrés Tirapegui, Horacio Poblete, Gloria Cárdenas-Jirón, Emilio Alarcón, Alexis Aspée, Physical Chemistry Chemical Physics, 20 (2018) 27621-27629.
76.- “Atypical antioxidant activity of non-phenolic amino-coumarins”, Daniel Zúñiga-Núñez, Pablo Barrías, Gloria Cárdenas-Jirón, M. Soledad Ureta-Zañartu, Camilo Lopez-Alarcón, F. Eduardo Morán Vieyra, Claudio D. Borsarelli, Emilio I. Alarcón, Alexis Aspée, RSC Advances, 8 (2018) 1927-1933.
75.- “Theoretical Assessment of TD-DFT Applied to Ferrocene-based Complex”, Mauricio Yáñez-S, Sergio A. Moya, Cesar Zúñiga, Gloria Cárdenas-Jirón, Computational and Theoretical Chemistry, 1118 (2017) 65-74.
74.- “Covalent Functionalization of Octagraphene with Magnetic Octahedral B6 – and Non-planar C6−Clusters”, Ernesto Chigo-Anota, Gloria Cárdenas-Jirón, M. Salazar Villanueva, A. Bautista Hernández, M. Castro, Physica E: Low-dimensional Systems and Nanostructures, 94 (2017) 196-203.
73.- “Reaction Kinetics of Phenolic Antioxidants Towards Photo-Induced Pyranine Free Radicals in Biological Models”, Alexis Aspée, Christian Aliaga, Luca Maretti, Daniel Zúñiga, Jessica Godoy, Eduardo Pino, Gloria Cárdenas-Jirón, Camilo Lopez-Alarcon, Juan C. Scaiano, Emilio Alarcon, Journal of Physical Chemistry B, 121 (2017) 6331-6340.
72.- “Insights on the Reactivity of Terminal Phosphanido Metal Complexes toward Activated Alkynes from Theoretical Computations”, Daniel Álvarez, Raúl Mera-Adasme, Lucía Riera, Gloria I. Cárdenas-Jirón, Julio Pérez, Jesús Díaz, María I. Menéndez, Ramón López, Inorganic Chemistry, 56 (2017) 6652-6661.
71.- “Excited States of Light-Harvesting Systems Based on Fullerene/Graphene Oxide and Porphyrin/Smaragdyrin”, Gloria Cárdenas-Jirón, Merlys Borges-Martínez, Ember Sikorski, Tunna Baruah, Journal of Physical Chemistry C, 121 (2017) 4859-4872.
70.- “Mechanistic Study of a Ruthenium Hydride Complex of type [RuH(CO)(N-N)(PR3)2]+ as Catalyst Precursor for the Hydroformylation Reaction of 1-hexene”, Sergio A. Moya, Mauricio Yañez-S, Catalina Pérez, Rosa López, César Zuñiga, Gloria Cárdenas-Jirón, Journal of Chilean Chemical Society, 61 (2016) 3014-3019.
69.- “Tautomerization Mechanism and Spectral Properties of Porphyrin-Glucose Complexes as Models of Antibacterial Material”, M. Isabel Menéndez, Ramón López, Mauricio Yañez, Gloria Cárdenas-Jirón, Theoretical Chemistry Accounts, 135 (2016) 1-15.
68.- "Doping Effects in the Charge Transport of Graphene-Porphyrins", Gloria I. Cárdenas-Jirón, Yanara Figueroa, Narendra Kumar, Jorge M. Seminario, Journal of Physical Chemistry C , 120 (2016) 2013-2016.