RIQUIM - Repositorio Institucional de la Facultad de Química - UdelaR

Artículo

Comparative study of antioxidant and pro-oxidant properties of homoleptic and heteroleptic copper complexes with amino acids, dipeptides and 1,10-Phenanthroline: the quest for antitumor compounds.

Artículo

T- and pH-Dependent Kinetics of the Reactions of ·OH(aq) with Glutaric and Adipic Acid for Atmospheric Aqueous-Phase Chemistry

Artículo

Novel bisthiazole ligand and its copper(II) complex with unusual seven membered ring: synthesis, characterization, experimental and theoretical study of the effect of ligand flexibility, and antimicrobial activity

Artículo

Tunable and sizeable band gaps in strained SiC3/hBN vdW heterostructures: a potential replacement for graphene in future nanoelectronics

Artículo

Isomerization and fragmentation reactions on the [C2SH4] potential energy surface: the metastable thione S-Methylide isomer.

Artículo

Bi2S3 and MoS2 Soft Coatings: a comparative study of their frictional behavior under different humidity levels, normal loads, and sliding speeds

Artículo

Impact of oxygen adsorption on the electronic properties and contact type of a defective epitaxial graphene-SiC interface

Artículo

Exchange coupling in a thiocyanato-bridged copper(II) chain: computational approach to magnetostructural correlations

Artículo

Thermodynamic functions and vibrational properties of Li intercalation in TiO2(B)

Artículo

C–doped TiO2(B): a density functional theory characterization

Artículo

Detection of SOF2 and SO2F2 through aluminium nitride nanosheets: a DFT study

Tesis

Caracterización teórica de nanomateriales bidimensionales sobre sustratos

Artículo

Optical, electrical and structural properties of Fe doped sodium titanate nanostructures

Artículo

Dinuclear complex of Cu(II) containing chloride and methoxide as bridging ligands: a new crystal structure and DFT calculations.

Artículo

Hydrogen titanate nanotubes for dye sensitized solar cells applications : Experimental and theoretical study

Artículo

Curvature and vacancies in graphene quantum dots

Artículo

Sulfur doping in multivacancy graphene systems.

Etiquetas: Azufre, DFT, Grafeno

Navegue los elementos (17 total)

Comparative study of antioxidant and pro-oxidant properties of homoleptic and heteroleptic copper complexes with amino acids, dipeptides and 1,10-Phenanthroline: the quest for antitumor compounds.

T- and pH-Dependent Kinetics of the Reactions of ·OH(aq) with Glutaric and Adipic Acid for Atmospheric Aqueous-Phase Chemistry

Novel bisthiazole ligand and its copper(II) complex with unusual seven membered ring: synthesis, characterization, experimental and theoretical study of the effect of ligand flexibility, and antimicrobial activity

Tunable and sizeable band gaps in strained SiC3/hBN vdW heterostructures: a potential replacement for graphene in future nanoelectronics

Isomerization and fragmentation reactions on the [C2SH4] potential energy surface: the metastable thione S-Methylide isomer.

Bi2S3 and MoS2 Soft Coatings: a comparative study of their frictional behavior under different humidity levels, normal loads, and sliding speeds

Impact of oxygen adsorption on the electronic properties and contact type of a defective epitaxial graphene-SiC interface

Exchange coupling in a thiocyanato-bridged copper(II) chain: computational approach to magnetostructural correlations

Thermodynamic functions and vibrational properties of Li intercalation in TiO2(B)

C–doped TiO2(B): a density functional theory characterization

Detection of SOF2 and SO2F2 through aluminium nitride nanosheets: a DFT study

Caracterización teórica de nanomateriales bidimensionales sobre sustratos

Optical, electrical and structural properties of Fe doped sodium titanate nanostructures

Dinuclear complex of Cu(II) containing chloride and methoxide as bridging ligands: a new crystal structure and DFT calculations.

Hydrogen titanate nanotubes for dye sensitized solar cells applications : Experimental and theoretical study

Curvature and vacancies in graphene quantum dots

Sulfur doping in multivacancy graphene systems.

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