| 1 | AI-assisted models to predict chemotherapy drugs modified with C60 fullerene derivatives | Coautor: Miralrio, A, Robles-Hernández, JSL, Medina, DI, Aguirre-Hurtado, K, et al. | 2024 | BEILSTEIN JOURNAL OF NANOTECHNOLOGY | WoS-id: 001318408400001
| 0 | 0 |
| 2 | Enhanced water molecule sensitivity on defective WS2 monolayers through (ZnO)12 spherical nanocages decoration: A theoretical study | Coautor: Miralrio A., Rangel B.E., Fonseca G.J.V., de Oca S.M., et al. | 2024 | JOURNAL OF MOLECULAR LIQUIDS | Scopus-id: 2-s2.0-85207944479
| 0 | 0 |
| 3 | Corrosion inhibition with a perezone-impregnated Mg/Al hydrotalcite coating in AS21 alloy | Coautor: Miralrio, Alan, Casillas, Gabriel Espinosa, Vazquez, Araceli Espinoza, Gómez F.J.R., et al. | 2023 | ELECTROCHIMICA ACTA | WoS-id: 000998997400001
Scopus-id: 2-s2.0-85154595179
| 1 | 1 |
| 4 | Substitutional Coinage Metals as Promising Defects for Adsorption and Detection of Gases on MoS2 Monolayers: A Computational Approach | Coautor: Miralrio, Alan, Gutierrez-Rodriguez, Josue, Castro, Miguel, Nieto-Jalil, Jose Manuel, et al. | 2023 | INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES | WoS-id: 001017156300001
Scopus-id: 2-s2.0-85164031224
| 1 | 2 |
| 5 | Electrochemical evaluation of Trasar trac 102 as a corrosion inhibitor on API 5L X65 steel and theoretical study | Coautor: Miralrio A., Espinoza-Vázquez A., Santiago Cárdenas L.J., Galván-Martínez R., et al. | 2023 | JOURNAL OF ELECTROANALYTICAL CHEMISTRY | WoS-id: 001032805500001
Scopus-id: 2-s2.0-85162166541
| 1 | 1 |
| 6 | 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 | Coautor: Miralrio, Alan, Espinoza-Vazquez, Araceli, Rodríguez-Gómez F.J., Figueroa-Vargas I.A., et al. | 2022 | INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES | WoS-id: 000775363900001
Scopus-id: 2-s2.0-85126285830
| 1 | 2 |
| 7 | Identifying the mechanistic insights into PbSeO3 decomposition, during milling, to give way to PbSe: An experimental and theoretical approach | 2ᵒ autor: Miralrio A., Rojas-Chávez H., Cruz-Martínez H., Martínez-Espinosa J.A., et al. | 2022 | COMPUTATIONAL MATERIALS SCIENCE | WoS-id: 000789897400008
Scopus-id: 2-s2.0-85125705839
| 2 | 3 |
| 8 | 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 | Coautor: Miralrio A., Beltran-Perez C., Serrano A.A.A., Solís-Rosas G., et al. | 2022 | INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES | WoS-id: 000799214300001
Scopus-id: 2-s2.0-85129432592
| 19 | 25 |
| 9 | Corrosion inhibition of 1-benzyl-4-((benzyloxy) methyl)-1H-1,2,3-triazole (BBT) for C844 bronze in saline medium and theoretical study | Coautor: Miralrio A., von Putlitz G.S., Vázquez A.E., Gómez F.J.R., et al. | 2022 | JOURNAL OF MOLECULAR STRUCTURE | WoS-id: 000827717200001
Scopus-id: 2-s2.0-85133236591
| 2 | 3 |
| 10 | Imidazolate of 1-butyl-3-ethyl imidazole as corrosion inhibitor on API 5L X52 steel in NaCl saturated with CO2 | Coautor: Miralrio, A., Ontiveros-Rosales, M., Espinoza-Vazquez, A., Rodríguez Gómez F.J., et al. | 2022 | JOURNAL OF MOLECULAR LIQUIDS | WoS-id: 000834616200011
Scopus-id: 2-s2.0-85134891650
| 19 | 20 |
| 11 | Corrosion inhibition assessment on API 5L X70 steel by preussomerin G immersed in saline and saline acetic | Coautor: Miralrio, Alan, Espinoza Vazquez, Araceli, Lopez Resendiz, Luis Antonio, Figueroa, Ignacio A., et al. | 2021 | JOURNAL OF ADHESION SCIENCE AND TECHNOLOGY | WoS-id: 000575973800001
Scopus-id: 2-s2.0-85092384264
| 17 | 18 |
| 12 | (?) ? Epicatechin gallate as a corrosion inhibitor for bronze in a saline medium and theoretical study | Coautor: Miralrio, A., Espinoza Vázquez A., Figueroa, I. A., Gómez F.J.R., et al. | 2021 | JOURNAL OF MOLECULAR STRUCTURE | WoS-id: 000609155200001
Scopus-id: 2-s2.0-85092936952
| 9 | 12 |
| 13 | Oriented-Attachment- And Defect-Dependent PbTe Quantum Dots Growth: Shape Transformations Supported by Experimental Insights and DFT Calculations | 2ᵒ autor: Miralrio A., Rojas-Chávez H., Cruz-Martínez H., Carbajal-Franco G., et al. | 2021 | INORGANIC CHEMISTRY | WoS-id: 000653539100042
Scopus-id: 2-s2.0-85106380364
| 8 | 8 |
| 14 | Inhibition of acid corrosion in API 5L X52 steel with 1,2,3-triazole derivatized from benzyl alcohol: Experimental and theoretical studies | Coautor: Miralrio, A., Espinoza Vazquez, A., Gonzalez-Olvera, R., Moreno Cerros, D., et al. | 2021 | JOURNAL OF MOLECULAR STRUCTURE | WoS-id: 000675891100008
Scopus-id: 2-s2.0-85111014956
| 15 | 18 |
| 15 | Small Transition-Metal Mixed Clusters as Activators of the C-O Bond. FenCum-CO (n plus m=6): A Theoretical Approach | 2ᵒ autor: Miralrio, Alan, Limon, Patricio, Gomez-Balderas, Rodolfo, Castro, Miguel | 2021 | JOURNAL OF PHYSICAL CHEMISTRY A | WoS-id: 000697333300017
Scopus-id: 2-s2.0-85114873286
| 3 | 4 |
| 16 | Needle- and cross-linked ZnO microstructures and their photocatalytic activity using experimental and DFT approach | 2ᵒ autor: Miralrio A., Rojas-Chávez H., Hernández-Rodríguez Y.M., Cruz-Martínez H., et al. | 2021 | MATERIALS LETTERS | Scopus-id: 2-s2.0-85101348371
| 0 | 8 |
| 17 | Chemical interaction between nitrogen-doped graphene defects and a copper (1?1?1) surface: Effects on water molecule adsorption | Coautor: Miralrio A., Cardozo?Mata V.A., Pescador?Rojas J.A., Hernández?Hernández A., et al. | 2020 | APPLIED SURFACE SCIENCE | WoS-id: 000498639000008
Scopus-id: 2-s2.0-85074401622
| 12 | 14 |
| 18 | Structures, stabilities and aromatic properties of endohedrally transition metal doped boron clusters M@B-22, M = Sc and Ti: a theoretical study | Coautor: Miralrio, Alan, Celaya, Christian A., Buendia, Fernando, Paz-Borbon, Lauro Oliver, et al. | 2020 | PHYSICAL CHEMISTRY CHEMICAL PHYSICS | WoS-id: 000529178800037
Scopus-id: 2-s2.0-85083546248
| 8 | 7 |
| 19 | Characterization of Magnetic Series of Iron-Carbon Clusters FenC0,+/- 1 (n <= 13) | 2ᵒ autor: Miralrio, Alan, Limon, Patricio, Castro, Miguel | 2020 | JOURNAL OF PHYSICAL CHEMISTRY C | WoS-id: 000529873300044
Scopus-id: 2-s2.0-85085152913
| 12 | 12 |
| 20 | Plant extracts as green corrosion inhibitors for different metal surfaces and corrosive media: A review | 1ᵉʳ autor: Miralrio A., Vázquez A.E. | 2020 | Processes | WoS-id: 000568071700001
Scopus-id: 2-s2.0-85090035100
| 173 | 239 |
| 21 | Fluconazole and fragments as corrosion inhibitors of API 5L X52 steel immersed in 1M HCl | Coautor: Miralrio, A., Espinoza-Vazquez, A., Rodriguez-Gomez, F. J., Negron-Silva, G. E., et al. | 2020 | CORROSION SCIENCE | WoS-id: 000569368000005
Scopus-id: 2-s2.0-85087524183
| 26 | 34 |
| 22 | Carbon Monoxide Activation on Small Iron Magnetic Cluster Surfaces, FenCO, n=1-20. A Theoretical Approach | 2ᵒ autor: Miralrio, Alan, Limon, Patricio, Gomez-Balderas, Rodolfo, Castro, Miguel | 2020 | JOURNAL OF PHYSICAL CHEMISTRY A | WoS-id: 000598115400006
Scopus-id: 2-s2.0-85096583442
| 9 | 9 |
| 23 | M@C-50 as Higher Intermediates towards Large Endohedral Metallofullerenes: Theoretical Characterization, Aromatic and Bonding Properties from Relativistic DFT Calculations | 1ᵉʳ autor: Miralrio A., Muñoz-Castro A., King R.B., Sansores L.E. | 2019 | JOURNAL OF PHYSICAL CHEMISTRY C | WoS-id: 000456350600047
Scopus-id: 2-s2.0-85060158915
| 18 | 17 |
| 24 | Mycophenolic acid as a corrosion inhibitor of carbon steel in 3% wt. NaCl solution. An experimental and theoretical study | Coautor: Miralrio A., Rodríguez-Gómez F.J., Valdelamar M.P., Vazquez A.E., et al. | 2019 | JOURNAL OF MOLECULAR STRUCTURE | WoS-id: 000459865900019
Scopus-id: 2-s2.0-85061343526
| 30 | 35 |
| 25 | Activation of MoS 2 monolayers by substitutional copper and silver atoms embedded in sulfur vacancies: A theoretical study | 1ᵉʳ autor: Miralrio, Alan, Rangel, Eduardo, Castro, Miguel | 2019 | APPLIED SURFACE SCIENCE | WoS-id: 000472176900074
Scopus-id: 2-s2.0-85063082220
| 9 | 10 |
| 26 | Organometallic complexes of carbon nanotori | 2ᵒ autor: Miralrio, Alan, del Castillo, Roxana M., Rios, Citlalli, Salcedo, Roberto | 2019 | JOURNAL OF MOLECULAR MODELING | WoS-id: 000481812500005
Scopus-id: 2-s2.0-85069521299
| 4 | 4 |
| 27 | Intermediates for Larger Endohedral Metallofullerenes: Theoretical Characterization of M@C-44 Species | 1ᵉʳ autor: Miralrio A., Muñoz-Castro A., King R.B., Sansores L.E. | 2018 | JOURNAL OF PHYSICAL CHEMISTRY C | WoS-id: 000422814200085
Scopus-id: 2-s2.0-85040525164
| 11 | 12 |
| 28 | Catalytic Reduction of Nitrous Oxide by the Low-Symmetry Pt8 Cluster | Coautor: Miralrio A., Hernández E., Bertin V., Soto J., et al. | 2018 | JOURNAL OF PHYSICAL CHEMISTRY A | WoS-id: 000426802600030
Scopus-id: 2-s2.0-85042798751
| 17 | 17 |
| 29 | Adsorption and dissociation of carbon monoxide on iron and iron-carbon clusters: Fen?+?2CO and FenC?+?2CO, n?=?4 and 7. A theoretical study | 2ᵒ autor: Miralrio A., Limon P., Castro M. | 2018 | COMPUTATIONAL AND THEORETICAL CHEMISTRY | WoS-id: 000429514800005
Scopus-id: 2-s2.0-85042783059
| 16 | 16 |
| 30 | Electronic properties and enhanced reactivity of MoS 2 monolayers with substitutional gold atoms embedded into sulfur vacancies | 1ᵉʳ autor: Miralrio, Alan, Rangel Cortes, Eduardo, Castro, Miguel | 2018 | APPLIED SURFACE SCIENCE | WoS-id: 000438578700089
Scopus-id: 2-s2.0-85048265331
| 25 | 27 |
| 31 | C50Cl10, a planar aromatic fullerene. Computational study of 13C-NMR chemical shift anisotropy patterns and aromatic properties | 1ᵉʳ autor: Miralrio A., Sansores L.E., King B., Muñoz-Castro A. | 2018 | PHYSICAL CHEMISTRY CHEMICAL PHYSICS | WoS-id: 000448665900030
Scopus-id: 2-s2.0-85055597239
| 3 | 3 |
| 32 | Structures, stabilities, and electronic properties of fullerene C-36 with endohedral atomic Sc, Y, and La: A dispersion-corrected DFT study | 1ᵉʳ autor: Miralrio, Alan, Enrique Sansores, Luis | 2017 | INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | WoS-id: 000397255300001
Scopus-id: 2-s2.0-85005765007
| 10 | 11 |
| 33 | Complexes of graphene nanoribbons with porphyrins and metal-encapsulated C28 as molecular rectifiers: a theoretical study | 2ᵒ autor: Miralrio, A., Montiel, F., Sansores, L.E., Fomine, S. | 2017 | MOLECULAR SIMULATION | WoS-id: 000399569700004
Scopus-id: 2-s2.0-85015053653
| 5 | 6 |
| 34 | Weak bonds between molecular tweezers and their guests | Coautor: Miralrio, Alan, Bosquez, Marlene, Cambray, Alejandra, del Castillo, Roxana-Mitzaye, et al. | 2017 | COMPUTATIONAL AND THEORETICAL CHEMISTRY | WoS-id: 000408300800044
Scopus-id: 2-s2.0-85025153097
| 4 | 4 |
| 35 | Theoretical study of the stability and properties of magic numbers (m = 5, n = 2) and (m = 6, n = 3) of bimetallic bismuth-copper nanoclusters; Bim Cun | 1ᵉʳ autor: Miralrio, Alan, Hernandez-Hernandez, Arturo, Pescador-Rojas, Jose A., Sansores, Enrique, et al. | 2017 | INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | WoS-id: 000414173400003
Scopus-id: 2-s2.0-85033487170
| 4 | 5 |
| 36 | On the search of stable, aromatic and ionic endohedral compounds of C28: A theoretical study | 1ᵉʳ autor: Miralrio, Alan, Enrique Sansores, Luis | 2016 | COMPUTATIONAL AND THEORETICAL CHEMISTRY | WoS-id: 000374427000008
Scopus-id: 2-s2.0-84961122193
| 30 | 30 |
| 37 | Influence of TCNQ acceptor on optical and electrical properties of tetrasubstituted allenes films fabricated by vacuum thermal evaporation | Coautor: Miralrio, Alan, Sanchez-Vergara, M. E., Leyva-Esqueda, E. A., Alvarez, C., et al. | 2016 | JOURNAL OF MATERIALS SCIENCE-MATERIALS IN ELECTRONICS | WoS-id: 000381159800141
Scopus-id: 2-s2.0-84976324419
| 6 | 6 |
| 38 | Electronic structure and stability of binary and ternary aluminum-bismuth-nitrogen nanoclusters | 1ᵉʳ autor: Miralrio, A, Sansores, LE | 2014 | INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | WoS-id: 000337603700005
Scopus-id: 2-s2.0-84901951399
| 9 | 9 |
| 39 | Theoretical study of the electronic structure of gold clusters over graphene | 1ᵉʳ autor: Miralrio, A, Sansores, LE | 2013 | Abstracts Of Papers Of The American Chemical Society | WoS-id: 000323851304315
| 0 | 0 |
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