Browsing by author "García Algarra, Andrés"

Computational Insights into the Isomerism of Hexacoordinate Metal–Sarcophagine Complexes: The Relationship between Structure and Stability

García Algarra, Andrés (Willey, 2015)

Computational Insights into the Mechanisms of H2 Activation and H2/D2 Isotope Exchange by Dimolybdenum Tetrasulfide Complexes

García Algarra, Andrés (Willey, 2016)

Computational Insights on the Geometrical Arrangements of Cu(II) with a Mixed-Donor N3S3 Macrobicyclic Ligand

García Algarra, Andrés; Aullón, Gabriel; V. Bernhardt, Paul; Martínez, Manuel (ACS Publications, 2014)

Cycloaddition of alkynes to diimino Mo3S4 cubane-type clusters: a combined experimental and theoretical approach

García Algarra, Andrés; Pino-Chamorro, Jose Ángel; A. Laricheva, Yuliya; Guillamón, Eva; Fernández-Trujillo Rey, María Jesús; Bustelo, Emilio; L. Gushchin, Artem; Y. Shmelev, Nikita; A. Abramov, Pavel; N. Sokolov, Maxim; Llusar, Rosa; García Basallote, Manuel (The Royal Society of Chemistry and Owner Societies, 2016)

A DFTand TD-DFTApproach to the Understanding of Statistical Kinetics in Substitution Reactions of M3Q4 (M=Mo, W; Q=S, Se) Cuboidal Clusters

García Algarra, Andrés; Fernández-Trujillo Rey, María Jesús; García Basallote, Manuel (Willey, 2012)

Equilibrium and kinetics studies on bibrachial lariat aza-crown/Cu(II) systems reveal different behavior associated with small changes in the structure

Castillo González, Carmen Esther; García Algarra, Andrés; Ferrer, Armando; Máñez Muñoz, María de los Angeles; García Basallote, Manuel; Clares, M. Paz; Soriano, Concepción; Albelda, M. Teresa; García-España, Enrique (Elsevier, 2014)

Estudio del comportamientocinético-mecanístico de clústeres M3Q4 (M = Mo, W; Q = S, Se) y compuestos relacionados

García Algarra, Andrés (Servicio de Publicaciones de la Universidad de Cádiz, 2009-06-01)

Kinetic and DFT Studies on the Mechanism of C−S Bond Formation by Alkyne Addition to the [Mo3S4(H2O)9]4+ Cluster

Pino-Chamorro, Jose Ángel; García Algarra, Andrés; Fernández-Trujillo Rey, María Jesús; Hernández-Molina, Rita; García Basallote, Manuel (ACS Publications, 2013-11)

Kinetics Aspects of the Reversible Assembly of Copper in Heterometallic Mo3CuS4 Clusters with 4,4′-Di-tert-butyl-2,2′- bipyridine

Pino-Chamorro, Jose Ángel; A. Laricheva, Yuliya; Guillamón, Eva; Fernández-Trujillo Rey, María Jesús; García Algarra, Andrés; L. Gushchin, Artem; A. Abramov, Pavel; Bustelo, Emilio; Llusar, Rosa; N. Sokolov, Maxim; García Basallote, Manuel (2016-09)

Mechanism of [3+2] Cycloaddition of Alkynes to the [Mo₃S₄(acac)₃(py)₃][PF₆] Cluster

Pino-Chamorro, Jose Ángel; L. Gushchin, Artem; Fernández-Trujillo Rey, María Jesús; Hernández-Molina, Rita; Vicent, Cristian; García Algarra, Andrés; García Basallote, Manuel (Willey, 2015)

Multiple metal-bound oligomers from Ir-catalysed dehydropolymerisation of H3B$NH3 as probed by experiment and computation

Kumar, Amit; C. Johnson, Heather; N. Hooper, Thomas; S. Weller, Andrew; García Algarra, Andrés; A. Macgregor, Stuart (ROYAL SOC CHEMISTRY, 2014)

On the Critical Effect of the Metal (Mo vs. W) on the [3++2] Cycloaddition Reaction of M3S4 Clusters with Alkynes: Insights from Experiment and Theory

Bustelo, Emilio; L. Gushchin, Artem; Fernández-Trujillo Rey, María Jesús; García Basallote, Manuel; García Algarra, Andrés (Willey, 2015)

The Solution Chemistry of Cu2+–tren Complexes Revisited: Exploring the Role of Species That Are Not Trigonal Bipyramidal

Castillo González, Carmen Esther; García Algarra, Andrés; Mañez Muñoz, María de los Angeles; Duboc, Carole; García Basallote, Manuel (Willey, 2012)

Browsing by author "García Algarra, Andrés"

Computational Insights into the Isomerism of Hexacoordinate Metal–Sarcophagine Complexes: The Relationship between Structure and Stability ﻿

Computational Insights into the Mechanisms of H2 Activation and H2/D2 Isotope Exchange by Dimolybdenum Tetrasulfide Complexes ﻿

Computational Insights on the Geometrical Arrangements of Cu(II) with a Mixed-Donor N3S3 Macrobicyclic Ligand ﻿

Cycloaddition of alkynes to diimino Mo3S4 cubane-type clusters: a combined experimental and theoretical approach ﻿

A DFTand TD-DFTApproach to the Understanding of Statistical Kinetics in Substitution Reactions of M3Q4 (M=Mo, W; Q=S, Se) Cuboidal Clusters ﻿

Equilibrium and kinetics studies on bibrachial lariat aza-crown/Cu(II) systems reveal different behavior associated with small changes in the structure ﻿

Estudio del comportamientocinético-mecanístico de clústeres M3Q4 (M = Mo, W; Q = S, Se) y compuestos relacionados ﻿

Kinetic and DFT Studies on the Mechanism of C−S Bond Formation by Alkyne Addition to the [Mo3S4(H2O)9]4+ Cluster ﻿

Kinetics Aspects of the Reversible Assembly of Copper in Heterometallic Mo3CuS4 Clusters with 4,4′-Di-tert-butyl-2,2′- bipyridine ﻿

Mechanism of [3+2] Cycloaddition of Alkynes to the [Mo₃S₄(acac)₃(py)₃][PF₆] Cluster ﻿

Multiple metal-bound oligomers from Ir-catalysed dehydropolymerisation of H3B$NH3 as probed by experiment and computation ﻿

On the Critical Effect of the Metal (Mo vs. W) on the [3++2] Cycloaddition Reaction of M3S4 Clusters with Alkynes: Insights from Experiment and Theory ﻿

The Solution Chemistry of Cu2+–tren Complexes Revisited: Exploring the Role of Species That Are Not Trigonal Bipyramidal ﻿

Computational Insights into the Isomerism of Hexacoordinate Metal–Sarcophagine Complexes: The Relationship between Structure and Stability

Computational Insights into the Mechanisms of H2 Activation and H2/D2 Isotope Exchange by Dimolybdenum Tetrasulfide Complexes

Computational Insights on the Geometrical Arrangements of Cu(II) with a Mixed-Donor N3S3 Macrobicyclic Ligand

Cycloaddition of alkynes to diimino Mo3S4 cubane-type clusters: a combined experimental and theoretical approach

A DFTand TD-DFTApproach to the Understanding of Statistical Kinetics in Substitution Reactions of M3Q4 (M=Mo, W; Q=S, Se) Cuboidal Clusters

Equilibrium and kinetics studies on bibrachial lariat aza-crown/Cu(II) systems reveal different behavior associated with small changes in the structure

Estudio del comportamientocinético-mecanístico de clústeres M3Q4 (M = Mo, W; Q = S, Se) y compuestos relacionados

Kinetic and DFT Studies on the Mechanism of C−S Bond Formation by Alkyne Addition to the [Mo3S4(H2O)9]4+ Cluster

Kinetics Aspects of the Reversible Assembly of Copper in Heterometallic Mo3CuS4 Clusters with 4,4′-Di-tert-butyl-2,2′- bipyridine

Mechanism of [3+2] Cycloaddition of Alkynes to the [Mo₃S₄(acac)₃(py)₃][PF₆] Cluster

Multiple metal-bound oligomers from Ir-catalysed dehydropolymerisation of H3B$NH3 as probed by experiment and computation

On the Critical Effect of the Metal (Mo vs. W) on the [3++2] Cycloaddition Reaction of M3S4 Clusters with Alkynes: Insights from Experiment and Theory

The Solution Chemistry of Cu2+–tren Complexes Revisited: Exploring the Role of Species That Are Not Trigonal Bipyramidal