scholarly journals Surface Strain Effect Engineers the Catalytic Performance of Pd Nanocrystals in CO2 Electrochemical Reduction

2017 ◽  
Vol 33 (4) ◽  
pp. 651-652
Author(s):  
Xin-He BAO ◽  
2021 ◽  
Author(s):  
Fan Lv ◽  
Bolong Huang ◽  
Jianrui Feng ◽  
Weiyu Zhang ◽  
Kai Wang ◽  
...  

Abstract The multi-metallene with an ultrahigh surface area has a great potential in precise tuning of surface heterogeneous d-electronic correlation by surface strain effect for the distinctive surface electronic structure, which is a brand new class of promising 2D electrocatalyst for sustainable energy device application. However, achieving such atomically thin multi-metallene still confronts a grand challenge. Herein, we present a new synthetic method for an atomic-level palladium-iridium (PdIr) bimetallene with an average thickness of only ∼1.0 nm for achieving superior catalysis for hydrogen evolution reaction (HER) and formic acid oxidation reaction (FAOR). The curved PdIr bimetallene presents a top-ranked high electrochemical active area of 127.5 ± 10.8 m2 gPd+Ir−1 in the reported noble alloy materials, and exhibits a very low overpotential, ultrahigh activity and improved stability for HER and FAOR. DFT calculation reveals the PdIr bimetallene herein has the unique lattice tangential strain, which can induce the surface distortion with concurrently creating a variety of concave-convex featured micro-active-region formed by variously coordinated Pd-sites-agglomeration. Such strong strain effect correlates the abnormal on-site active 4d10-t2g-orbital Coulomb correlation potential and directly elevates orbital-electronegativity exposing within these active regions, resulting in preeminent barrier-free energetic path for significant enhancement of FAOR and HER catalytic performance.


Crystals ◽  
2020 ◽  
Vol 11 (1) ◽  
pp. 30
Author(s):  
Xiaoyan Liu ◽  
Lei Wang ◽  
Yi Tong

First-principle density functional theory simulations have been performed to predict the electronic structures and optoelectronic properties of ultrathin indium tin oxide (ITO) films, having different thicknesses and temperatures. Our results and analysis led us to predict that the physical properties of ultrathin films of ITO have a direct relation with film thickness rather than temperature. Moreover, we found that a thin film of ITO (1 nm thickness) has a larger absorption coefficient, lower reflectivity, and higher transmittance in the visible light region compared with that of 2 and 3 nm thick ITO films. We suggest that this might be due to the stronger surface strain effect in 1 nm thick ITO film. On the other hand, all three thin films produce similar optical spectra. Finally, excellent agreement was found between the calculated electrical resistivities of the ultrathin film of ITO and that of its experimental data. It is concluded that the electrical resistivities reduce along with the increase in film thickness of ITO because of the short strain length and limited bandgap distributions.


2021 ◽  
Author(s):  
Jingbo Huang ◽  
Qixing Liu ◽  
Yucong Yan ◽  
Ningkang Qian ◽  
Xingqiao Wu ◽  
...  

Strain effect is a critical knob to tune the catalytic performance and has received unprecedented research interests recently. However, it is difficult to distinguish strain effect from synergistic effect, especially...


Coatings ◽  
2020 ◽  
Vol 10 (12) ◽  
pp. 1142
Author(s):  
Chen Chi ◽  
Donghong Duan ◽  
Zhonglin Zhang ◽  
Guoqiang Wei ◽  
Yu Li ◽  
...  

The electrochemical reduction of CO2 to methanol is a promising strategy, which currently suffers from the poor catalytic activity, selectivity, and stability of the electrode. Here, we report a simple one-pot hydrothermal strategy to fabricate Mo–Bi BMC@CNT nanocomposites, in which Mo–Bi bimetallic chalcogenide nanoparticles were in-situ decorated on carbon nanotubes. The Mo–Bi BMC nanoparticles with an average particle size of 12 nm were uniformly supported on the surface of CNTs without aggregation into larger clusters. The Mo–Bi BMC@CNT nanocomposites exhibited a relatively good catalytic performance for the electrochemical reduction of CO2 to methanol in a 60 wt.% 1-ethyl-3-methylimidazolium tetrafluoroborate aqueous electrolyte. Among them, the Mo–Bi BMC@CNT-15% nanocomposite showed the highest Faradaic efficiency of 81% for methanol at −0.3 V vs. a saturated calomel reference electrode (SCE) and a stable current density is 5.6 mA cm−2 after a run time of 12 h. The excellent catalytic properties are likely attributed to its nanostructure and fast electron transfer. These derive from the synergistic effect of Mo–Bi and the high conductivity of CNTs. This work opens a way to provide an efficient catalytic system for the electroreduction of CO2 to methanol in industrial applications.


2018 ◽  
Vol 6 (17) ◽  
pp. 7547-7556 ◽  
Author(s):  
Zhongxu Wang ◽  
Jingxiang Zhao ◽  
Jingyang Wang ◽  
Carlos R. Cabrera ◽  
Zhongfang Chen

Co–N4-embedded graphene exhibits superior catalytic performance for NO electrochemical reduction with a lower onset potential than that of Pt-based catalyst.


2019 ◽  
Vol 21 (41) ◽  
pp. 22704-22710 ◽  
Author(s):  
Yu-Te Chan ◽  
I-Shou Huang ◽  
Ming-Kang Tsai

In this study, 121 copper(100) models with surface strain are used for simulating C–C bond formation by CO2 electrochemical reduction.


Nanomaterials ◽  
2019 ◽  
Vol 9 (2) ◽  
pp. 173 ◽  
Author(s):  
Yuanxing Wang ◽  
Cailing Niu ◽  
Yachuan Zhu

The electrochemical conversion of carbon dioxide (CO2) into gaseous or liquid fuels has the potential to store renewable energies and reduce carbon emissions. Here, we report a three-step synthesis using Cu–Ag bimetallic nanowire arrays as catalysts for electrochemical reduction of CO2. CuO/Cu2O nanowires were first grown by thermal oxidation of copper mesh in ambient air and then reduced by annealing in the presence of hydrogen to form Cu nanowires. Cu–Ag bimetallic nanowires were then produced via galvanic replacement between Cu nanowires and the Ag+ precursor. The Cu–Ag nanowires showed enhanced catalytic performance over Cu nanowires for electrochemical reduction of CO2, which could be ascribed to the incorporation of Ag into Cu nanowires leading to suppression of hydrogen evolution. Our work provides a method for tuning the selectivity of copper nanocatalysts for CO2 reduction by controlling their composition.


Catalysts ◽  
2019 ◽  
Vol 9 (5) ◽  
pp. 476 ◽  
Author(s):  
Qianwen Li ◽  
Mei Li ◽  
Shengbo Zhang ◽  
Xiao Liu ◽  
Xinli Zhu ◽  
...  

Copper-based bimetallic catalysts have been recently showing promising performance for the selective electrochemical reduction of CO2. In this work, we successfully fabricated the partially reduced oxides SnOx, CuOxmodified Cu foam electrode (A-Cu/SnO2) through an electrodeposition-annealing-electroreduction approach. Notably, in comparison with the control electrode (Cu/SnO2) without undergoing annealing step, A-Cu/SnO2 exhibits a significant enhancement in terms of CO2 reduction activity and CO selectivity. By investigating the effect of the amount of the electrodeposited SnO2, it is found that A-Cu/SnO2 electrodes present the characteristic Sn-Cu synergistic catalysis with a feature of dominant CO formation (CO faradaic efficiency, 70~75%), the least HCOOH formation (HCOOH faradaic efficiency, <5%) and the remarkable inhibition of hydrogen evolution reaction. In contrast, Cu/SnO2 electrodes exhibit a SnO2 coverage-dependent catalysis—a shift from CO selectivity to HCOOH selectivity with the increasing deposited SnO2 on Cu foam. The different catalytic performance between Cu/SnO2 and A-Cu/SnO2 might be attributed to the different content of Cu atoms in SnO2 layer, which may affect the density of Cu-Sn interface on the surface. Our work provides a facile annealing-electroreduction strategy to modify the surface composition for understanding the metal effect towards CO2 reduction activity and selectivity for bimetallic Cu-based electrocatalysts.


Catalysts ◽  
2020 ◽  
Vol 10 (10) ◽  
pp. 1102
Author(s):  
Fengyang Ju ◽  
Jinjin Zhang ◽  
Weiwei Lu

The electrochemical reduction of CO2 is a promising way to recycle it to produce value-added chemicals and fuels. However, the requirement of high overpotential and the low solubility of CO2 in water severely limit their efficient conversion. To overcome these problems, in this work, a new type of electrolyte solution constituted by ionic liquids and propylene carbonate was used as the cathodic solution, to study the conversion of CO2 on an Ag electrode. The linear sweep voltammetry (LSV), Tafel characterization and electrochemical impedance spectroscopy (EIS) were used to study the catalytic effect and the mechanism of ionic liquids in electrochemical reduction of CO2. The LSV and Tafel characterization indicated that the chain length of 1-alkyl-3-methyl imidazolium cation had strong influences on the catalytic performance for CO2 conversion. The EIS analysis showed that the imidazolium cation that absorbed on the Ag electrode surface could stabilize the anion radical (CO2•−), leading to the enhanced efficiency of CO2 conversion. At last, the catalytic performance was also evaluated, and the results showed that Faradaic efficiency for CO as high as 98.5% and current density of 8.2 mA/cm2 could be achieved at −1.9 V (vs. Fc/Fc+).


2016 ◽  
Vol 16 (02) ◽  
pp. 1650027 ◽  
Author(s):  
Ali Azizi ◽  
Sadollah Ebrahimi

It has been recently investigated [A. Azizi and S. Ebrahimi, Nano 9, 1450088 (2004).] the Paclitaxel (PTX) anticancer drug molecule adsorption on nitrogen doped graphene (NG). However, the surface strain effect on adsorption is not considered in the literature. In this study, using molecular dynamics (MD) simulation, we show that the PTX molecule adsorption can be tuned by exploiting the rippling effect of the strained NG. The dependence of the nitrogen concentration in the presence of ripples on the surface, arising due to thermal fluctuations, is examined. We have also considered the connection between the average distance of PTX from NG surface and the maximum induced deformation on the surface structure. It is demonstrated that the average distance of PTX from NG is increased with increasing the strain until a critical value is reached, and then it has remained almost constant. To this end, the dependence of the degree of ripple-type distortion of the surface on the PTX adsorption is investigated.


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