Desmond MacLeod-Carey Castro
Universidad Autónoma de Chile
H-index: 15
Latin America-Chile
Top articles of Desmond MacLeod-Carey Castro
Title | Journal | Author(s) | Publication Date |
|---|---|---|---|
Adsorption of a Ni single atom catalyst on a pristine nanographene (coronene) and HH activation. A theoretical study of Ni-SAC | Chemical Physics Letters | Yenner Bentarcurt Desmond MacLeod-Carey Marcos Loroño Morella Sánchez Fernando Ruette | 2024/3/16 |
Geometry optimization and UV/Vis spectra of organometallic chalcones functionalized with a benzo‐15‐crown‐5 fragment: A DFT/TD-DFT investigation | Inorganica Chimica Acta | Hanane Djouama Rabie Djouama Desmond MacLeod-Carey Narimane Nafti | 2024/2/1 |
From 8- to 18-Cluster Electrons Superatoms: Evaluation via DFT Calculations of the Ligand-Protected W@Au12(dppm)6 Cluster Displaying Distinctive Electronic … | Inorganic Chemistry | Jianyu Wei Desmond MacLeod Carey Jean-François Halet Samia Kahlal Jean-Yves Saillard | 2023/2/3 |
Formation of C60-SnI4 adducts. Insights of the role of σ-hole and tetrel-bonding in the strength and interaction nature from DFT calculations | Inorganica Chimica Acta | Ricardo A Murcia Desmond MacLeod-Carey John J Hurtado Alvaro Muñoz-Castro | 2023/1/24 |
Influence of the thermal stability of ammonium perchlorate in presence of heteroleptic copper (I) complexes bearing ethane-1, 2-diimine and biphosphines | Inorganica Chimica Acta | David Moreno da Costa Marco A Henriquez Diego Gonzalez-Torres César Zuñiga-Loyola Iván Brito | 2023/1/24 |
Cl@ Si 20 X 20 cages: evaluation of encapsulation nature, structural rigidity, and 29 Si-NMR patterns using relativistic DFT calculations | Physical Chemistry Chemical Physics | Desmond MacLeod-Carey Peter L Rodríguez-Kessler Alvaro Muñoz-Castro | 2023 |
Switch from local to global aromatic character in Möbius carbon nanobelts upon dioxidation. Evaluation of magnetic behavior in neutral and charged species | Physical Chemistry Chemical Physics | Desmond Macleod-Carey Alvaro Muñoz-Castro | 2023 |
Antifungal activity of Co (II) and Cu (II) complexes containing 1, 3-bis (benzotriazol-1-yl)-propan-2-ol on the growth and virulence traits of fluconazole-resistant Candida … | BMC chemistry | Ricardo A Murcia-Galán Sandra M Durán Sandra M Leal-Pinto Martha V Roa-Cordero Jose D Vargas | 2023/10/10 |
Synthesis and Theoretical Study of New Guanylated Cyclophosphazenes and Their Use in the CO2 Fixation into Styrene Carbonate | Journal of Inorganic and Organometallic Polymers and Materials | María Luisa Valenzuela Desmond MacLeod-Carey Cristian Soto Marfull José León-Baeza Javier Martínez | 2022/5 |
Machine learning approach to discovery of small molecules with potential inhibitory action against vasoactive metalloproteases | Molecular Diversity | Yudith Canizares-Carmenate Karel Mena-Ulecia Desmond MacLeod Carey Yunier Perera-Sardiña Erix W Hernandez-Rodriguez | 2022/6 |
Evaluation of C60 and C70 analogs bearing Cyclo‐meta‐Phenylene faces as improved devices for Polymer: Fullerene solar cells from DFT calculations | Dyes and Pigments | Desmond MacLeod Carey Alvaro Munoz-Castro | 2021/1/1 |
On the 13C‐NMR chemical shift anisotropy patterns and aromatic character in strained fullerenes: Computational analysis of D6h/D2d‐C36 fullerene | International Journal of Quantum Chemistry | Raul Guajardo‐Maturana Peter L Rodríguez‐Kessler Desmond MacLeod‐Carey Alvaro Muñoz‐Castro | 2021/1/15 |
Burning Rate Performance Study of Ammonium Perchlorate Catalyzed by Heteroleptic Copper(I) Complexes with Pyrazino[2,3‐f][1,10]phenanthroline‐Based Ligands | European Journal of Inorganic Chemistry | Manuel A Escobar Cesar Morales‐Verdejo Juan Luis Arroyo Paulina Dreyse Iván González | 2021/5/7 |
Full recombinant flagellin B from Vibrio anguillarum (rFLA) and its recombinant D1 domain (rND1) promote a pro-inflammatory state and improve vaccination against P. salmonis in … | Developmental & Comparative Immunology | Roxana González-Stegmaier Andrea Peña Franz Villarroel-Espíndola Patricia Aguila Cristian Oliver | 2021/4/1 |
Heterobimetallic catalysts for the thermal decomposition of ammonium perchlorate: efficient burning rate catalysts for solid rocket motors and missiles | Inorganic chemistry | Juan Luis Arroyo Angel Norambuena Hector Reyes Cristian Valdebenito Gabriel Abarca | 2021/1/14 |
Catalytic effect of [trans-Cu (μ-OH)(μ-dmpz)] 6 on the thermal decomposition of ammonium perchlorate | Polyhedron | Vanessa Molina Juan Luis Arroyo Desmond MacLeod-Carey Alvaro Muñoz-Castro Cesar Morales-Verdejo | 2021/11/15 |
Theoretical Evaluation of Novel Thermolysin Inhibitors from Bacillus thermoproteolyticus. Possible Antibacterial Agents | Molecules | Emilio Lamazares Desmond MacLeod-Carey Fernando P Miranda Karel Mena-Ulecia | 2021/1/13 |
Relativistic effects on dative carbon-coinage metal bond. Evaluation of NHC-MCl (M= Cu, Ag, Au) from relativistic DFT | Polyhedron | Alvaro Muñoz-Castro Desmond MacLeod Carey Ramiro Arratia-Perez | 2021/3/15 |
On the Aromaticity and 13C-NMR Pattern of Pentagonal-Pyramidal Hexamethylbenzene Dication [C6(CH3)6]2+: A {C5(CH3)5}−–{CCH3}3+ Aggregate | Chemistry | Desmond MacLeod-Carey Alvaro Muñoz-Castro | 2021/11/11 |
Reply to ‘Comment on “Structural characterization, reactivity, and vibrational properties of silver clusters: A new global minimum for Ag 16”’by PV Nhat, NT Si, LV Duong and MT … | Physical Chemistry Chemical Physics | Peter L Rodríguez-Kessler Adán R Rodríguez-Domínguez Desmond MacLeod-Carey Alvaro Muñoz-Castro | 2021 |
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