Publications by the researcher in collaboration with Dage Sundholm (10)

2024

  1. Experimental and computational studies of the optical properties of 2,5,8-tris(phenylthiolato)heptazine with an inverted singlet-triplet gap

    Physical Chemistry Chemical Physics, Vol. 26, Núm. 7, pp. 5922-5931

2023

  1. A “gold standard” computational proof for the existence of gold(iii) aurophilicity

    Dalton Transactions, Vol. 52, Núm. 8, pp. 2219-2222

  2. Gold(i)-containing light-emitting molecules with an inverted singlet-triplet gap

    Chemical Science, Vol. 14, Núm. 14, pp. 3873-3880

  3. Understanding Li interaction in TiO2/graphene composites for high-performance Li-ion battery anodes: A first principles study

    Physica B: Condensed Matter, Vol. 660

2022

  1. Gold(I)···Lanthanide(III) Bonds in Discrete Heterobimetallic Compounds: A Combined Computational and Topological Study

    Inorganic Chemistry, Vol. 61, Núm. 50, pp. 20308-20315

  2. Influence of perhalophenyl groups in the TADF mechanism of diphosphino gold(i) complexes

    Journal of Materials Chemistry C, Vol. 10, Núm. 12, pp. 4894-4904

2020

  1. Perhalophenyl Three-Coordinate Gold(I) Complexes as TADF Emitters: A Photophysical Study from Experimental and Computational Viewpoints

    Inorganic Chemistry, Vol. 59, Núm. 19, pp. 14236-14244

2016

  1. Double Jahn-Teller Distortion in AuGe Complexes Leading to a Dual Blue-Orange Emission

    ChemPlusChem, Vol. 81, Núm. 2, pp. 176-186

2014

  1. Double photoinduced jahn-teller distortion of tetrahedral Au I-SnII complexes

    ChemPlusChem, Vol. 79, Núm. 1, pp. 67-76

2000

  1. Luminescent characterization of solution oligomerization process mediated gold-gold interactions. DTF calculations on [Au2Ag2R4L2]n moieties.

    Journal of the American Chemical Society, Vol. 122, Núm. 30, pp. 7287-7293