Miralrio-Pineda, Alan Joel

academic article in scopus

• Linking experimental findings and theoretical insights on the mechanochemical synthesis of PbTe quantum dots: The effect of ethylene glycol.  Materials Today Communications.  2024
• Identifying the effect of tributyl phosphate on the growth of PbTe quantum dots: Linking experimental and theoretical approaches.  Applied Surface Science.  2023
• Gas Sensing and Half-Metallic Materials Design Using Metal Embedded into S Vacancies in WS2 Monolayers: Adsorption of NO, CO, and O2 Molecules.  International Journal of Molecular Sciences.  2023
• Electrochemical evaluation of Trasar trac 102 as a corrosion inhibitor on API 5L X65 steel and theoretical study.  Journal of Electroanalytical Chemistry.  943. 2023
• Corrosion inhibition with a perezone-impregnated Mg/Al hydrotalcite coating in AS21 alloy.  Electrochimica Acta.  456. 2023
• Study of the Electronic Interaction between NiO and Short Polythiophene Chains towards Solar Photon Harvesting.  International Journal of Molecular Sciences.  24. 2023
• Substitutional Coinage Metals as Promising Defects for Adsorption and Detection of Gases on MoS2 Monolayers: A Computational Approach.  International Journal of Molecular Sciences.  2023
• Corrosion inhibition of 1-benzyl-4-((benzyloxy) methyl)-1H-1,2,3-triazole (BBT) for C844 bronze in saline medium and theoretical study.  Journal of Molecular Structure.  1267. 2022
• A Comparative DFT Study on Process Control Agents in the Mechanochemical Synthesis of PbTe.  International Journal of Molecular Sciences.  23. 2022
• Imidazolate of 1-butyl-3-ethyl imidazole as corrosion inhibitor on API 5L X52 steel in NaCl saturated with CO2.  Journal of Molecular Liquids.  363. 2022
• A General Use QSAR-ARX Model to Predict the Corrosion Inhibition Efficiency of Drugs in Terms of Quantum Mechanical Descriptors and Experimental Comparison for Lidocaine.  International Journal of Molecular Sciences.  23. 2022
• Identifying the mechanistic insights into PbSeO3 decomposition, during milling, to give way to PbSe: An experimental and theoretical approach.  Computational Materials Science.  206. 2022
• 4-Phenylcoumarin (4-PC) Glucoside from Exostema caribaeum as Corrosion Inhibitor in 3% NaCl Saturated with CO2 in AISI 1018 Steel. Experimental and Theoretical Study.  International Journal of Molecular Sciences.  23. 2022
• Inhibition of acid corrosion in API 5L X52 steel with 1,2,3-triazole derivatized from benzyl alcohol: Experimental and theoretical studies.  Journal of Molecular Structure.  1242. 2021
• Small Transition-Metal Mixed Clusters as Activators of the C-O Bond. FenCum-CO (n+m= 6): A Theoretical Approach.  Journal of Physical Chemistry A.  125:7940-7955. 2021
• Oriented-Attachment- And Defect-Dependent PbTe Quantum Dots Growth: Shape Transformations Supported by Experimental Insights and DFT Calculations.  Inorganic Chemistry.  60:7196-7206. 2021
• Needle- and cross-linked ZnO microstructures and their photocatalytic activity using experimental and DFT approach.  Materials Letters.  291. 2021
• (¿) ¿ Epicatechin gallate as a corrosion inhibitor for bronze in a saline medium and theoretical study.  Journal of Molecular Structure.  1227. 2021
• Corrosion inhibition assessment on API 5L X70 steel by preussomerin G immersed in saline and saline acetic.  Journal of Adhesion Science and Technology.  35:873-899. 2021
• Carbon Monoxide Activation on Small Iron Magnetic Cluster Surfaces, FenCO, n = 1-20. A Theoretical Approach.  Journal of Physical Chemistry A.  124:9951-9962. 2020
• Fluconazole and fragments as corrosion inhibitors of API 5L X52 steel immersed in 1M HCl.  Corrosion Science.  174. 2020
• Plant extracts as green corrosion inhibitors for different metal surfaces and corrosive media: A review.  Processes.  8. 2020
• Characterization of Magnetic Series of Iron-Carbon Clusters Fe nC0,±1 (n ¿ 13).  Journal of Physical Chemistry C.  124:9484-9495. 2020
• Structures, stabilities and aromatic properties of endohedrally transition metal doped boron clusters M@B22, M = Sc and Ti: A theoretical study.  Physical Chemistry Chemical Physics.  22:8077-8087. 2020
• Chemical interaction between nitrogen-doped graphene defects and a copper (1¿1¿1) surface: Effects on water molecule adsorption.  Applied Surface Science.  502. 2020
• Organometallic complexes of carbon nanotori.  Journal of Molecular Modeling.  25. 2019