Publicaciones en colaboración con investigadores/as de Consiglio Nazionale delle Ricerche (20)

2021

  1. The Role of Non-Covalent Interactions on Cluster Formation: Pentamer, Hexamers and Heptamer of Difluoromethane

    Angewandte Chemie - International Edition, Vol. 60, Núm. 31, pp. 16894-16899

2020

  1. Chlorination and tautomerism: A computational and UPS/XPS study of 2-hydroxypyridine ⇌ 2-pyridone equilibrium

    Physical Chemistry Chemical Physics, Vol. 22, Núm. 24, pp. 13440-13455

2019

  1. A General Treatment to Study Molecular Complexes Stabilized by Hydrogen-, Halogen-, and Carbon-Bond Networks: Experiment and Theory of (CH2F2)n⋅⋅⋅(H2O)m

    Angewandte Chemie - International Edition, Vol. 58, Núm. 25, pp. 8437-8442

2016

  1. Isolated attosecond water-window pulses driven by 1.8 μm lasers

    Optics InfoBase Conference Papers

2004

  1. Tight-binding parameterization of transition and noble metal clusters

    International Journal of Quantum Chemistry

2002

  1. A theoretical study of the catalytic properties of Pt/Fe nanoclusters

    Journal of Molecular Structure: THEOCHEM, Vol. 586, Núm. 1-3, pp. 17-27

2000

  1. Local properties of PT/FE nanoclusters from EHT calculations

    Journal of Molecular Structure: THEOCHEM, Vol. 528, Núm. 1-3, pp. 1-12

1997

  1. C-H bond cleavage in thiophenes by [P(CH2CH2PPh2)3Ru]. UV flash kinetic spectroscopy discloses the ruthenium-thiophene adduct which precedes C-H insertion

    Organometallics, Vol. 16, Núm. 21, pp. 4611-4619

  2. Efficient rhodium catalysts for the hydrogenolysis of thiophenic molecules in homogeneous phase

    Polyhedron, Vol. 16, Núm. 18, pp. 3099-3114

  3. Insertion of iridium into C-H and C-S bonds of 2,5-dimethylthiophene, 2-methylbenzothiophene and 4,6-dimethyldibenzothiophene

    Journal of Organometallic Chemistry, Vol. 541, Núm. 1-2, pp. 143-155

  4. Photochemistry of M(PP3)H2 (M = Ru, Os; PP3 = P(CH2CH2PPh2)3): Preparative, NMR, and time-resolved studies

    Journal of the American Chemical Society, Vol. 119, Núm. 36, pp. 8459-8473

  5. Ring-puckering motion in 1-chloro-cyclopentene: Rotational spectrum and ab initio calculations

    Journal of Molecular Spectroscopy, Vol. 181, Núm. 1, pp. 91-98

1996

  1. The mechanism of the Ru-assisted C-C bond cleavage of terminal alkynes by water

    Journal of the American Chemical Society, Vol. 118, Núm. 19, pp. 4585-4594

1995

  1. Metal Activation of Dibenzo [b,d] thiophene. Reactivity of the C-S Insertion Product [MeC(CH2PPh2)3]IrH(η2(C,S)-C12H8S)

    Organometallics, Vol. 14, Núm. 10, pp. 4850-4857

1990

  1. Conformation and ring inversion in γ-butyrolacetone. Part 2.-Ab initio and flexible model computations

    Journal of the Chemical Society, Faraday Transactions, Vol. 86, Núm. 3, pp. 459-466

  2. Conformation and ring inversion in γ-butyrolactone. Part 1. - Microwave spectrum

    Journal of the Chemical Society, Faraday Transactions, Vol. 86, Núm. 3, pp. 453-458

1987

  1. Microwave spectra and internal rotation in α-angelicalactone

    Journal of Molecular Spectroscopy, Vol. 124, Núm. 1, pp. 199-208

1986

  1. Centrifugal distortion and the ring puckering vibration in the microwave spectrum of 2,3-dihydrofuran

    Journal of Molecular Structure, Vol. 147, Núm. 3-4, pp. 255-265

  2. Microwave spectra and ring-puckering vibration in dihydrothiophenes

    Journal of Molecular Structure, Vol. 142, Núm. C, pp. 97-103

1985

  1. The microwave spectrum of 2-methyl-4,5-dihydrofuran

    Journal of Molecular Spectroscopy, Vol. 112, Núm. 1, pp. 26-38