Listar Investigación y Desarrollo por autor "Arratia-Perez R."
Mostrando ítems 1-15 de 15
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Review
Advances in bonding and properties of inorganic systems from relativistic calculations in Latin America (2020)
Macleod-Carey D.; Caramori G.F.; Guajardo-Maturana R.; Paez-Hernandez D.; Muñoz-Castro A.; Arratia-Perez R. (John Wiley and Sons Inc., 2019) -
Article
Bonding in gold-rare earth [Au2M] (M = Eu, Yb, Lu) ions. A strong covalent gold-lanthanide bond (2020)
Páez-Hernández D.; Muñoz-Castro A.; Arratia-Perez R. (Elsevier B.V., 2017) -
Article
Coinage Metal Superatomic Cores: Insights into Their Intrinsic Stability and Optical Properties from Relativistic DFT Calculations (2020)
Gam F.; Paez-Hernandez D.; Arratia-Perez R.; Liu C.W.; Kahlal S.; Saillard J.-Y.; Muñoz-Castro A. (Wiley-VCH Verlag, 2017) -
Article
Comparative study of the anchorage and the catalytic properties of nanoporous TiO2 films modified with ruthenium (II) and rhenium (I) carbonyl complexes (2020)
Oyarzún D.P.; Chardon-Noblat S.; Linarez Pérez O.E.; López Teijelo M.; Zúñiga C.; Zarate X.; Shott E.; Carreño A.; Arratia-Perez R. (Elsevier B.V., 2018) -
Article
DFT studies on coordination models for adsorption essays of Cu(II) and Ni(II) solutions in modified silica gel with iminodiacetic groups (2020)
Carreño A.; Schott E.; Zarate X.; Manriquez J.M.; Vega J.C.; Mardones M.; Cowley A.H.; Chavez I.; Hinestroza J.P.; Arratia-Perez R. (Springer International Publishing, 2017) -
Article
Experimental and theoretical studies of the ancillary ligand (E)-2-((3-amino-pyridin-4-ylimino)-methyl)-4,6-di-tert-butylphenol in the rhenium(i) core (2020)
Carreño A.; Gacitua M.; Schott E.; Zarate X.; Manriquez J.M.; Preite M.; Ladeira S.; Castel A.; Pizarro N.; Vega A.; ... (Royal Society of Chemistry, 2015) -
Article
Magnetically induced current density using London atomic orbitals of dihydroindeno-[1,2-b]-fluorenes (2020)
Barboza C.A.; Bast R.; Barboza E.; MacLeod-Carey D.; Arratia-Perez R. (Royal Society of Chemistry, 2018) -
Article
Optical and electronic properties of benzopyrylium derivatives. Theoretical-experimental synergy towards novel DSSCs devices (2020)
Tirapegui C.; Rojas-Poblete M.; Arratia-Perez R.; Linares-Flores C.; Islas R.; Schott E.; Guajardo-Maturana R. (Elsevier Ltd, 2019) -
Article
Potential to stabilize 16-vertex tetrahedral coinage-metal cluster architectures related to Au20 (2020)
Gam F.; Arratia-Perez R.; Kahlal S.; Saillard J.-Y.; Muñoz-Castro A. (Royal Society of Chemistry, 2019) -
Article
Reactivity trends of Fe phthalocyanines confined on graphite electrodes in terms of donor-acceptor intermolecular hardness: Linear versus volcano correlations (2020)
Linares-Flores C.; Espinoza-Vergara J.; Zagal J.H.; Arratia-Perez R. (Elsevier, 2014) -
Article
Role of donor-acceptor functional groups in N3P3 cyclic-triphosphazene backbone. Unraveling bonding characteristics from natural orbitals within an extended transition state-natural orbital for the chemical valence scheme (2020)
Linares-Flores C.; Ramirez-Tagle R.; Rojas-Poblete M.; Arratia-Perez R.; Muñoz-Castro A.; Guajardo-Maturana R. (John Wiley and Sons Inc., 2020) -
Article
Spin-orbit effect into isomerization barrier of small gold Clusters. Oh ↔ D2h Fluxionality of the Au62+ cluster Investigated by relativistic methods (2020)
Muñoz-Castro A.; Paez-Hernandez D.; Arratia-Perez R. (Elsevier B.V., 2017) -
Article
Surface on Surface. Survey of the Monolayer Gold-Graphene Interaction from Au12 and PAH via Relativistic DFT Calculations (2020)
Muñoz-Castro A.; Gomez T.; Carey D.M.; Miranda-Rojas S.; Mendizabal F.; Zagal J.H.; Arratia-Perez R. (American Chemical Society, 2016) -
Article
Survey of short and long cuprophilic d10-d10 contacts for tetranuclear copper clusters. Understanding of bonding and ligand role from a planar superatom perspective (2020)
Claveria-Cadiz F.; Arratia-Perez R.; Guajardo-Maturana R.; Muñoz-Castro A. (Royal Society of Chemistry, 2018) -
Article
Symmetry lowering by cage doping in spherical superatoms: Evaluation of electronic and optical properties of 18-electron W@Au 12 Pt n (n = 0-4) superatomic clusters from relativistic DFT calculations (2020)
Gam F.; Arratia-Perez R.; Kahlal S.; Saillard J.-Y.; Muñoz-Castro A. (John Wiley and Sons Inc., 2019)