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Results: 1752

J. Oscar C. Jiménez-Halla, F. Matthias Bickelhaupt, Miquel Solà
Organomagnesium clusters: Structure, stability, and bonding in archetypal models
Journal of Organometallic Chemistry, 2011, 696, 4104-4111
DOI: 10.1016/j.jorganchem.2011.06.014

D. L. Andrews, Carles Curutchet, G.D. Scholes
Resonance energy transfer: Beyond the limits
Laser & Photon. Rev., 2011, 5, 114-123
DOI: 10.1002/lpor.201000004

Irene Prat, Jennifer S. Mathieson, Mireia Güell, Xavi Ribas, Josep M. Luis, Leroy Cronin, Miquel Costas
Observation of Fe(V)=O using variable-temperature mass spectrometry and its enzyme-like CH and C=C oxidation reactions
Nature Chem, 2011, 3, 788-793
DOI: 10.1038/NCHEM.1132

Julio Lloret Fillol, Zoel Codolà, Isaac Garcia-Bosch, Laura Gómez, JuanJosé Pla, Miquel Costas
Efficient water oxidation catalysts based on readily available iron coordination complexes
Nature Chem, 2011, 3, 807-813
DOI: 10.1038/NCHEM.1140

Anna Dachs, Anna Roglans, Miquel Solà
RhCl(PPh3)3-catalyzed intramolecular cycloaddition of enediynes: the nature of the tether and substituents controls the reaction mechanism
Organometallics, 2011, 30, 3151-3159
DOI: 10.1021/om200227e

Diego M. Andrada, Alejandro M. Granados, Miquel Solà, Israel Fernández
DFT Study of Thermal 1,3-Dipolar Cycloaddition Reactions between Alkynyl Metal(0) Fischer Carbene Complexes and 3
Organometallics, 2011, 30, 466-476
DOI: 10.1021/om1007105

Stefano Caprasecca, Carles Curutchet, Benedetta Mennucci
Quantum mechanical study of the solvent-dependence of electronic energy transfer rates in a Bodipy closely-spaced dyad
Photochem. Photobiol. Sci., 2011, 10, 1602-1609
DOI: 10.1039/c1pp05141e

Marcel Swart, Mireia Güell, Miquel Solà
A multi-scale approach to spin crossover in Fe(ii) compounds
Phys. Chem. Chem. Phys., 2011, 13, 10449-10456
DOI: 10.1039/c1cp20646j
OpenAccess: –
Keywords: Spin states

Benedetta Mennucci, Carles Curutchet
The role of the environment in electronic energy transfer: a molecular modeling perspective
Phys. Chem. Chem. Phys., 2011, 13, 11538-11550
DOI: 10.1039/c1cp20601j

Verónica Leyva, Inés Corral, Ferran Feixas, Annapaola Migani, Lluís Blancafort, Jesús González-Vázquez, Leticia González
A non-adiabatic quantum-classical dynamics study of the intramolecular excited state hydrogen transfer in ortho-nitrobenzaldehyde
Phys. Chem. Chem. Phys., 2011, 13, 14685-14693
DOI: 10.1039/c1cp20620f