Raúl Guajardo‐Maturana

Universidad SEK — Chile

Materials Science · Physical Sciences

8h-index223citations42works1.82yr avg
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Research Topics

Magnetism in coordination complexes(13), Nanocluster Synthesis and Applications(8), Organometallic Complex Synthesis and Catalysis(6), Supramolecular Chemistry and Complexes(6), Synthesis and Properties of Aromatic Compounds(6)

Publications42 total

Mechanochromic emission in ternary CB[8]TPA2 array. Insights into the role of host-interaction nature
Dyes and Pigments·2025
Ag16 clusters as host for halide encapsulation. computational evaluation of structural, interaction energy, and optical properties given by the inclusion of halides as non-innocent templates
Inorganic Chemistry Communications·2025· 1 cited
Evaluation of halide encapsulation in a cuboctahedron Cu12 cage. Structural and interaction energy in a highly coordinated cavity in the [{TpMo(μ3-S)4Cu3}4(μ12-X)]− (X = Cl−, Br−, I−) species
Chemical Physics Letters·2025· 1 cited
Insights into the Planarization of Benzo-Thianthrene Rings: Relevance of Electronic and Steric Effects with Resulting Aromatic Properties
The Journal of Physical Chemistry A·2025
Towards an efficient delayed fluorescence mechanism from charge transfer and local transitions. The role of heavy halide atoms
New Journal of Chemistry·2025· 1 cited
Coating the fullerene: evaluation of the core–shell interaction nature in a saturated exohedral cuprofullerene
Physical Chemistry Chemical Physics·2025· 1 cited
Formation and Characterization of Chitosan-Based Polyelectrolyte Complex Containing Antifungal Phenylpropanoids
Polymers·2024· 2 citedOpen Access
Nature of Cation‐π Interaction in Mono‐ and Inverted Sandwich Ga(I) Complexes. Insights Into the Ga(I)‐π Features and NMR Patterns from GaCp, GaCp*, [Ga<sub>2</sub>Cp]<sup>+</sup>, and [Ga<sub>2</sub>Cp*]<sup>+</sup>
European Journal of Inorganic Chemistry·2024· 1 cited
Benzene–Ni<sub>10</sub>S<sub>20</sub> Interaction. Host–Guest Features and Nuclear Magnetic Resonance Patterns toward Prototypical Metal-Based Active Cavities
The Journal of Physical Chemistry C·2024
4′–phenyl −2, 2′: 6′, 2′’-terpyridine derivatives as metal chemosensors. Chelation and fluorescence capabilities towards Zn(II), Cd(II), and Hg(II) from experiment and theory
Journal of Photochemistry and Photobiology A Chemistry·2024· 5 cited
Which fits better?. Centered and non-Centered coordination modes of small endohedral Fullerenes, insights from Ti@C28 and Zr@C28
Inorganica Chimica Acta·2024· 3 cited
Electronic pathway of the exciplex emitters. Unraveling the emission properties from theoretical calculations
Journal of Photochemistry and Photobiology A Chemistry·2024· 8 cited
On the halide aggregation into the [Au<sub>4</sub>(PPh<sub>3</sub>)<sub>4</sub>]<sup>4+</sup> cluster core. Insights from structural, optical and interaction energy analysis in [(Ph<sub>3</sub>PAu)<sub>4</sub>X<sub>2</sub>]<sup>2+</sup> and [(Ph<sub>3</sub>PAu)<sub>4</sub>X]<sup>3+</sup> species (X = Cl<sup>−</sup>, Br<sup>−</sup>, I<sup>−</sup>)
Physical Chemistry Chemical Physics·2024
On the variation of cluster core characteristics by an endohedral atom. Shape variation in 8-ce [EAu<sub>4</sub>(PPh<sub>3</sub>)<sub>4</sub>]<sup>2+</sup> (E = N, P, As, Sb) clusters
Physical Chemistry Chemical Physics·2024· 4 cited
4’–Phenyl -2, 2’: 6’, 2’’-Terpyridine Derivatives as Metal Chemosensors. Chelation and Fluorescence Capabilities Towards Zn(Ii), Cd(Ii), and Hg(Ii) from Experiment and Theory
SSRN Electronic Journal·2024Open Access
Unraveling the delayed fluorescence mechanism of copper(I) halide-phosphine emitters from DFT calculations
Results in Chemistry·2023· 4 citedOpen Access
The nature of the central halide encapsulation in bambusuril hosts (BU[6]). Structural and interaction energy insights in BU[6]·X− (X = Cl, Br, I) from relativistic DFT calculations
Inorganica Chimica Acta·2023· 8 cited
On the Cation-π capabilities of infinitene (∞). Evaluation of bonding and circular dichroism properties for Infinitene-Ag(I)n (n = 1–4) complexes from relativistic DFT calculations
Polyhedron·2023· 4 cited
Nature of the dative Nitrogen-Coinage metal bond in molecular Motors. Evaluation of NHC-M pyrazine bond (M = Cu, Ag, Au) from relativistic DFT
Inorganica Chimica Acta·2023· 2 cited
Nature and role of formal charge of the ion inclusion in hexanuclear Platinum(II) Host-Guest Species. Insights from relativistic DFT calculations
Inorganica Chimica Acta·2022· 2 cited
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Frequent Co-authors

Alvaro Muñoz‐Castro(35), Peter L. Rodríguez‐Kessler(17), Macarena Rojas‐Poblete(12), Giovanni F. Caramori(6), Eduardo Schott(6), Carolina Olea Ulloa(6), Ramiro Arratia‐Pérez(5), Cristian Linares‐Flores(5), Francisca Clavería-Cádiz(4), Renato L. T. Parreira(4), Luís Velásquez(4), Alexandre O. Ortolan(3), Plinio Cantero-López(3), Desmond MacLeod‐Carey(3), Miguel Ponce‐Vargas(2), Fernanda Ocayo(2), Cristián Tirapegui(2), Letícia Madureira(2), Rafael M. Piccoli(1), Maximiliano Segala(1)