Cargando…

DFT-Assisted Spectroscopic Studies on the Coordination of Small Ligands to Palladium: From Isolated Ions to Nanoparticles

[Image: see text] A combination of experimental spectroscopies (UV–vis and Fourier-transform infrared) and computational modeling was used to investigate the coordination of small ligands (aminopropanol and propanediol) to Pd species during the metal nanoparticle formation process. Differences emerg...

Descripción completa

Detalles Bibliográficos
Autores principales:	Campisi, Sebastiano, Beevers, Cameron, Nasrallah, Ali, Catlow, C. Richard A., Chan-Thaw, Carine e., Manzoli, Maela, Dimitratos, Nikolaos, Willock, David J., Roldan, Alberto, Villa, Alberto
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2020
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8016172/ https://www.ncbi.nlm.nih.gov/pubmed/33828633 http://dx.doi.org/10.1021/acs.jpcc.9b09791

Ejemplares similares

Metal-Support Cooperative Effects in Au/VPO for the Aerobic Oxidation of Benzyl Alcohol to Benzyl Benzoate
por: Campisi, Sebastiano, et al.
Publicado: (2019)

Hydrogen Generation from Additive-Free Formic Acid Decomposition Under Mild Conditions by Pd/C: Experimental and DFT Studies
por: Sanchez, Felipe, et al.
Publicado: (2018)

Enhanced Activity of Au/NiO Nanohybrids for the Reductive Amination of Benzyl Alcohol
por: Chan-Thaw, Carine E., et al.
Publicado: (2017)

Au-Based Catalysts: Electrochemical Characterization for Structural Insights
por: Pifferi, Valentina, et al.
Publicado: (2016)

Tailored N-Containing Carbons as Catalyst Supports in Alcohol Oxidation
por: Campisi, Sebastiano, et al.
Publicado: (2016)

Synthesis, Characterization, Thermal Analysis, DFT, and Cytotoxicity of Palladium Complexes with Nitrogen-Donor Ligands
por: Majeed, Sattar R., et al.
Publicado: (2022)

Ruling Factors in Cinnamaldehyde Hydrogenation: Activity and Selectivity of Pt-Mo Catalysts
por: Stucchi, Marta, et al.
Publicado: (2021)

A comparative study on the stability of the furfural molecule on the low index Ni, Pd and Pt surfaces
por: Khan, Alveena Z., et al.
Publicado: (2022)

Hydrous Hydrazine Decomposition for Hydrogen Production Using of Ir/CeO(2): Effect of Reaction Parameters on the Activity
por: Motta, Davide, et al.
Publicado: (2021)

l-Isoleucine-Schiff Base Copper(II) Coordination Polymers: Crystal Structure, Spectroscopic, Hirshfeld Surface, and DFT Analyses
por: Chavez-Urias, Iván F., et al.
Publicado: (2023)

DFT Calculations of (31)P NMR Chemical Shifts in Palladium Complexes
por: Kondrashova, Svetlana A., et al.
Publicado: (2022)

Topological prediction of palladium coordination cages
por: Poole, David A., et al.
Publicado: (2020)

Extracting structural information of Au colloids at ultra-dilute concentrations: identification of growth during nanoparticle immobilization
por: Tierney, George F., et al.
Publicado: (2019)

Nanosized SnO(2) Prepared by Electrospinning: Influence of the Polymer on Both Morphology and Microstructure
por: Rubin Pedrazzo, Alberto, et al.
Publicado: (2021)

The Effect of Pristine and Hydroxylated Oxide Surfaces on the Guaiacol HDO Process: A DFT Study
por: Morteo‐Flores, Fabian, et al.
Publicado: (2021)

Effect of Carbon Support, Capping Agent Amount, and Pd NPs Size for Bio-Adipic Acid Production from Muconic Acid and Sodium Muconate
por: Capelli, Sofia, et al.
Publicado: (2020)

Amino Alcohol Oxidation with Gold Catalysts: The Effect of Amino Groups
por: Villa, Alberto, et al.
Publicado: (2013)

Spectroscopic, DFT, and XRD Studies of Hydrogen Bonds in N-Unsubstituted 2-Aminobenzamides
por: Mphahlele, Malose Jack, et al.
Publicado: (2017)

Association of aescin with β- and γ-cyclodextrins studied by DFT calculations and spectroscopic methods
por: Ramos, Ana I, et al.
Publicado: (2017)

Solvation effect and binding of rhaponticin with iron: a spectroscopic and DFT/TDDFT study
por: Liu, Zhen, et al.
Publicado: (2019)

Comprehensive study on the degradation of ochratoxin A in water by spectroscopic techniques and DFT calculations
por: Cagnasso, Iris, et al.
Publicado: (2019)

Synthesis and Spectroscopic Characterization of Selected Phenothiazines and Phenazines Rationalized Based on DFT Calculation
por: Swoboda, Daniel, et al.
Publicado: (2022)

Spectroscopic and computational investigation of actinium coordination chemistry
por: Ferrier, Maryline G., et al.
Publicado: (2016)

Design, structural, spectral, DFT and analytical studies of novel nano-palladium schiff base complex
por: Akl, Magda A., et al.
Publicado: (2022)

Selective catalytic amination of halogenated aldehydes with calcined palladium catalysts
por: Villa, Alberto, et al.
Publicado: (2018)

A DFT Study of the Geometrical, Spectroscopical and Reactivity Properties of Diindolylmethane-Phenylboronic Acid Hybrids
por: Fragoso-Medina, Amira Jalil, et al.
Publicado: (2017)

Investigations of Optical Functions and Optical Transitions of 2D Semiconductors by Spectroscopic Ellipsometry and DFT
por: Gu, Honggang, et al.
Publicado: (2023)

Raman Spectroscopic Study of Five Typical Plasticizers Based on DFT and HF Theoretical Calculation
por: Sun, Tong, et al.
Publicado: (2023)

Design, Synthesis, Spectroscopic Inspection, DFT and Molecular Docking Study of Metal Chelates Incorporating Azo Dye Ligand for Biological Evaluation
por: Al-Gaber, Mohamed Ali Ibrahim, et al.
Publicado: (2023)

Stereochemical Properties of Two Schiff-Base Transition Metal Complexes and Their Ligand by Using Multiple Chiroptical Spectroscopic Tools and DFT Calculations
por: Li, Guojie, et al.
Publicado: (2023)

Recent progress on sonochemical production for the synthesis of efficient photocatalysts and the impact of reactor design
por: Adamou, Panayiota, et al.
Publicado: (2023)

Solvent coordination to palladium can invert the selectivity of oxidative addition
por: Elias, Emily K., et al.
Publicado: (2021)

Key Mechanistic Features in Palladium-Catalyzed Methylcyclopropanation of Norbornenes With Vinyl Bromides: Insights From DFT Calculations
por: Ying, Fang, et al.
Publicado: (2019)

Exploring the Mechanism of the Palladium-Catalyzed 3-Butene-2-ol Amination Reaction: A DFT Study
por: Lyu, Lingshan, et al.
Publicado: (2020)

Fertility Inhibitor Heterobimetallic Complexes of Platinum(II) and Palladium(II): Synthetic, Spectroscopic and Antimicrobial Aspects
por: Sharma, Kripa, et al.
Publicado: (2000)

Synthesis, X-ray Structure, Spectroscopic Properties and DFT Studies of a Novel Schiff Base
por: Chen, Kew-Yu, et al.
Publicado: (2014)

Crystal structure, spectroscopic characterization and DFT study of two new linear fused-ring chalcones
por: Zainuri, Dian Alwani, et al.
Publicado: (2018)

Facile Synthesis of Diversely Functionalized Peptoids, Spectroscopic Characterization, and DFT-Based Nonlinear Optical Exploration
por: Concepcion, Odette, et al.
Publicado: (2021)

Synthesis, spectroscopic, SC-XRD/DFT and non-linear optical (NLO) properties of chromene derivatives
por: Arif, Nadia, et al.
Publicado: (2022)

1,2,4-Triazine-based Materials: Spectroscopic Investigation, DFT, NBO, and TD-DFT Calculations as Well As Dye-sensitized Solar Cells Applications
por: Sakr, Mahmoud A. S., et al.
Publicado: (2022)

Cannot write session to /tmp/vufind_sessions/sess_gl9njk37ht7qugub3onqgf1gg5