Browsing by Author "Arratia Pérez, Ramiro"
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- ItemA DFT/TDDFT Study of Porphyrazines and Phthalocyanine Oxo-Titanium Derivatives as Potential Dyes in Solar Cells(2011) Zarate, Ximena; Schott Verdugo, Eduardo Enrique; Arratia Pérez, Ramiro
- ItemA new heterobimetallic manganese-rhodium carbonyl complex derived from partially alkylated s-indacene(2013) Morales Verdejo, César Aarón; Oehninger, Luciano; Martínez Díaz, Iván Enrique; Carey, Desmond Mac-Leod; Arratia Pérez, Ramiro; Chávez Madariaga, Ivonne; Manríquez M., Juan Manuel
- ItemADSORPTION ESSAYS OF PALLADIUM IN MODIFIED SILICA GEL WITH THIOURONIUM GROUPS: EXPERIMENTAL AND THEORICAL STUDIES(2011) Carreño, Alexander; Schott Verdugo, Eduardo Enrique; Zarate B., Ximena; Arratia Pérez, Ramiro; Vega de Kuyper, Juan Carlos; Mardones Lillo, Miguel Ángel; Manríquez M., Juan Manuel; Chávez Madariaga, Ivonne; Carreño, Alexander; Schott Verdugo, Eduardo Enrique; Zarate B., Ximena; Arratia Pérez, Ramiro; Vega de Kuyper, Juan Carlos; Mardones Lillo, Miguel Ángel; Manríquez M., Juan Manuel; Chávez Madariaga, Ivonne
- ItemAdvances in bonding and properties of inorganic systems from relativistic calculations in Latin America(2019) Macleod Carey, Desmond; Caramori, Giovanni F.; Guajardo Maturana, Raúl; Páez Hernández, Dayan; Muñoz Castro, Álvaro; Arratia Pérez, Ramiro
- ItemCatalytic aspects of metallophthalocyanines adsorbed on gold-electrode. Theoretical exploration of the binding nature role(2016) Miranda Rojas, Sebastián; Sierra Rosales, Paulina; Muñoz Castro, Alvaro; Arratia Pérez, Ramiro; Zagal Moya, José Heráclito; Mendizábal, Fernando
- Item[Cp*Ru(s-indacene)RuCp*] and [Cp*Ru(s-indacene)RuCp*](+): Experimental and theoretical findings concerning the electronic structure of neutral and mixed valence organometallic systems(2010) Mac-Leod, Carey, D.; Morales Verdejo, César Aarón; Muñoz-Castro, A.; Burgos, F.; Abril Milan, Diana Rosa; Adams Wrighton, Christopher William; Molins, E.; Cador, O.; Chávez Madariaga, Ivonne; Manríquez M., Juan Manuel; Arratia Pérez, Ramiro; Saillard, J.Y.
- ItemDFT studies on coordination models for adsorption essays of Cu(II) and Ni(II) solutions in modified silica gel with iminodiacetic groups(2017) Carreño, Alexander; Schott Verdugo, Eduardo Enrique; Zárate, Ximena; Manriquez, Juan Manuel; Vega, Juan C.; Mardones, Miguel; Cowley, Alan H.; Chávez Madariaga, Ivonne; Hinestroza, Juan P.; Arratia Pérez, Ramiro
- ItemDFT study on the electronic structure, energetics and spectral properties of several bis(organohydrazido(2-)) molybdenum complexes containing substituted phosphines and chloro atoms as ancillary ligands(2010) Zarate, Ximena; Schott Verdugo, Eduardo Enrique; Mac-Leod Carey, Desmond; Bustos, Carlos; Arratia Pérez, Ramiro
- ItemElectronic structure and metal-metal communication in (CpM)(2)(as-indacene) and (CpM)(2)(s-indacene) (M = Mn, Fe, Co, Ni) complexes: a DFT investigation(2011) Garland, Maria Teresa; Kahlal, Samia; Mac-Leod Carey, Desmond; Arratia Pérez, Ramiro; Manríquez M., Juan Manuel; Saillard, Jean-Yves
- ItemElectronic structure and molecular properties of paramagnetic hexanuclear Tantalum [Ta6X12Y6](3-) (X and Y = F, Cl, Br, I) cluster compounds(2012) Schott Verdugo, Eduardo Enrique; Zarate, Ximena; Arratia Pérez, Ramiro
- ItemElectronic structure and optical properties calculation of Zn-porphyrin with N-annulated perylene adsorbed on TiO2 model for dye-sensitized solar cell applications: A DFT/TD-DFT study(2017) Paredes Gil, Katherine; Mendizabal, Fernando; Páez Hernández, Dayán; Arratia Pérez, Ramiro
- ItemFrom Concentrated Dispersion to Solid beta-Cyclodextrin Polymer-Capped Silver Nanoparticle Formulation: A Trojan Horse Against Escherichia coli(2019) Martin Trasanco, Rudy; Anziani Ostuni, Giovanna; Esparza Ponce, Hilda Esperanza; Ortiz Rodríguez, Pedro David; Montero Cabrera, María E.; Oyarzún, Diego P.; Zúñiga, César; Pérez Donoso, José Manuel; Pizarro, Guadalupe del C.; Arratia Pérez, Ramiro
- ItemInteraction of LD14 and TiO2 in dye-sensitized solar-cells (DSSC) : A density functional theory study(2015) Mendizabal, Fernando; Lopéz, Alfredo; Arratia Pérez, Ramiro; Zapata-Torres, Gerald
- ItemInteraction of YD2 and TiO2 in dye-sensitized solar cells (DSSCs) : a density functional theory study(2015) Mendizabal, Fernando; Lopéz, Alfredo; Arratia Pérez, Ramiro; Inostroza, Natalia; Linares-Flores, Cristian
- ItemIntramolecular and Lateral Intermolecular Hole Transfer at the Sensitized TiO2 Interface(2014) Kiyoshi, Ke Hu; Robson, C.D; Beauvilliers, Evan E.; Schott Verdugo, Eduardo Enrique; Zarate, Ximena; Arratia Pérez, Ramiro; Berlinguette, Curtis P.; Meyer, Gerald J.
- ItemPhotophysical properties of [Cu(binap)(2)](+) and [Pd(binap)(2)] complexes : a theoretical study(2012) Zárate, Ximena; Schott Verdugo, Eduardo Enrique; Ramírez Tagle, Rodrigo; MacLeod Carey, Desmond; Arratia Pérez, Ramiro
- ItemRelativistic scalar and spin-orbit density functional calculations of the electronic structure, NICS index and ELF function of the [Re-2(CO)(8)(mu-BiPh)(2)] and [Re-2(CO)(8)(mu-BiPh2)(2)] clusters(2011) Schott Verdugo, Eduardo Enrique; Zárate, Ximena; Arratia Pérez, Ramiro
- ItemRole of the main adsorption modes in the interaction of the dye [COOH–TPP-Zn(ii)] on a periodic TiO2 slab exposing a rutile (110) surface in a dye-sentized solar cell(2014) Gómez, Tatiana; Zárate, Ximena; Schott Verdugo, Eduardo Enrique; Arratia Pérez, Ramiro
- ItemSimulation of natural dyes adsorbed on TiO2 for photovoltaic applications(2017) Gomez, Tatiana; Jaramillo, Franklin; Schott Verdugo, Eduardo Enrique; Arratia Pérez, Ramiro; Zarate, Ximena
- ItemSpectral, theoretical characterization and antifungal properties of two phenol derivative Schiff bases with an intramolecular hydrogen bond(2015) Carreño, Alexander; Gacitúa Santelices, Manuel Alejandro; Páez Hernández, Dayan; Polanco, Rubén; Preite, Marcelo Daniel; Fuentes, Juan A.; Mora, Guido C.; Chávez Madariaga, Ivonne; Arratia Pérez, Ramiro