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Ximena Zarate

Independent

SCHOLARLY PAPERS

4

DOWNLOADS

155

TOTAL CITATIONS

0

Scholarly Papers (4)

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1.

A Computational Chemistry Approach to the Molecular Design of Sio2 Nanoparticles with Stearic Acid and Sodium Stearate in Ethanol Solvent Medium

Number of pages: 46 Posted: 16 Jun 2023
Gabriela L. Galarza-Acosta, José G. Parra, Raiza O. Hernandez Bravo, Peter Iza, Eduardo Schott, Ximena Zarate, Jimmy Castillo and Vladimiro Mujica
affiliation not provided to SSRN, Universidad de Carabobo, affiliation not provided to SSRN, Independent, Pontificia Universidad Catolica de Chile, Independent, Universidad Central de Venezuela and Arizona State University (ASU)
Downloads 49 (1,086,013)

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adsorption, SiO2 NPs, Molecular Interactions, MD simulations

2.

Improving the Photocatalytic Properties of Tio2 Thin Films Modified with Anderson-Type Polyoxometallates (Cr, Co and Ni): Experimental and Dft Study

Number of pages: 24 Posted: 16 Sep 2022
Ximena Zarate, Carlos Diaz-Uribe, Freider Duran, William Vallejo, Esneyder Puello and Eduardo Schott
Independent, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and Pontificia Universidad Catolica de Chile
Downloads 40 (1,183,237)

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TiO2catalysisDFT

3.

A Computational Chemistry Approach to the Molecular Design of Sio2 Nanoparticles Coated with Stearic Acid and Sodium Stearate in Ethanol Solvent

Number of pages: 44 Posted: 07 Aug 2023
Gabriela L. Galarza-Acosta, José G. Parra, Raiza O. Hernandez Bravo, Peter Iza, Eduardo Schott, Ximena Zarate, Jimmy Castillo and Vladimiro Mujica
affiliation not provided to SSRN, Universidad de Carabobo, affiliation not provided to SSRN, Independent, Pontificia Universidad Catolica de Chile, Independent, Universidad Central de Venezuela and Arizona State University (ASU)
Downloads 38 (1,209,354)

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Adsorption, SiO2 NPs, Molecular Interactions, MD Simulations, Adhesion work, amphiphilic

4.

Unique Molecular Packing and Interfacial Properties of SDS Monolayers at the Air/Water Interface: Part I. All-Atom MD Simulations in the NPTxy Ensemble

Number of pages: 26 Posted: 19 May 2026
José G. Parra, Oscar Vera, Peter Iza, Hector Dominguez, Geraldine Rodriguez, Fernando Javier Torres, Eduardo Schott and Ximena Zarate
Universidad de Carabobo, Central University of Venezuela (UCV), Independent, Independent, University of Carabobo - University of Carabobo, Students, Universidad San Francisco de Quito (USFQ) - Grupo de Química Computacional y Teórica (QCT-USFQ), Pontificia Universidad Catolica de Chile and Independent
Downloads 28 (1,399,036)

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Surfactant monolayers, molecular dynamics, surface coverage, interfacial tension, hydrogen bonding, solvent accessible surface area