Toward the search for new photosensitizers for DSSCs: theoretical study of both substituted Zn(<scp>ii</scp>) and Si(<scp>iv</scp>) phthalocyanines

Zambrano-Angulo, Michael; Cárdenas-Jirón, Gloria

doi:10.1039/d3cp04417c

Phys. Chem. Chem. Phys.

2024

DOI: 10.1039/d3cp04417c

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Toward the search for new photosensitizers for DSSCs: theoretical study of both substituted Zn(ii) and Si(iv) phthalocyanines

Michael Zambrano-Angulo,

Gloria Cárdenas-Jirón

Abstract: We report a density functional theory (DFT) study performed for a set of 66 compounds based on Zinc (II) and Silicon (IV) phthalocyanines (Pcs) with potential applications in dye-sensitized solar...

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Cited by 4 publications

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Understanding the nature of the adsorption of Zn(II)/Si(IV) phthalocyanines on anatase TiO2 and rutile SnO2

Zambrano-Angulo,

Cárdenas-Jirón

2024

J Mol Model

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Understanding the nature of the adsorption of Zn(II)/Si(IV) phthalocyanines on anatase TiO2 and rutile SnO2

Zambrano-Angulo,

Cárdenas-Jirón

2024

J Mol Model

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Exploring structural and optical properties of iodine-doped TiO2 nanoparticles in Rhodamine-B dye degradation: Experimental and theoretical investigation

Raguram,

Rajni,

Kanchana

et al. 2024

Chemosphere

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One-pot Synthesis, Photophysical, Electrochemical and Molecular Property of Mixed-ligands Ruthenium Complex Functionalities: Potential Materials for Dye-Sensitized Solar Cells (DSSCs)

Adeloye,

Koudjina,

Kumar

et al. 2025

Dyes and Pigments

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Toward the search for new photosensitizers for DSSCs: theoretical study of both substituted Zn(ii) and Si(iv) phthalocyanines

Abstract: We report a density functional theory (DFT) study performed for a set of 66 compounds based on Zinc (II) and Silicon (IV) phthalocyanines (Pcs) with potential applications in dye-sensitized solar...

Cited by 4 publications

References 90 publications

Understanding the nature of the adsorption of Zn(II)/Si(IV) phthalocyanines on anatase TiO2 and rutile SnO2

Understanding the nature of the adsorption of Zn(II)/Si(IV) phthalocyanines on anatase TiO2 and rutile SnO2

Exploring structural and optical properties of iodine-doped TiO2 nanoparticles in Rhodamine-B dye degradation: Experimental and theoretical investigation

One-pot Synthesis, Photophysical, Electrochemical and Molecular Property of Mixed-ligands Ruthenium Complex Functionalities: Potential Materials for Dye-Sensitized Solar Cells (DSSCs)

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