4.8 Article

Catalytic activity of NiO cathode in molten carbonate fuel cells

Journal

APPLIED CATALYSIS B-ENVIRONMENTAL
Volume 222, Issue -, Pages 73-75

Publisher

ELSEVIER SCIENCE BV
DOI: 10.1016/j.apcatb.2017.10.003

Keywords

NiO; Cathode; MCFC; Sabatier analysis

Funding

  1. Interdisciplinary Centre for Mathematical and Computational Modeling (ICM) of the University of Warsaw [G61-4]
  2. Poznan Supercomputing and Networking Center (PSNC) [275]

Ask authors/readers for more resources

Molten carbonate fuel cells (MCFCs) have attracted significant attention because of their potential contribution to the development of a sustainable and clean-energy society. MCFC performance is governed by cathodic transformation of carbon dioxide to carbonate anion in complex: gas molten carbonate solid surface system. Based on our recently proposed reaction mechanism together with the density functional theory (DFT) calculated activation barriers we created a simplified microkinetic model to predict the catalytic activity of the NiO cathode. Under the MCFC operation condition the cathode surface in close proximity to the triple phase boundary (TPB) is highly active towards electro-reduction of oxygen and simultaneous formation of carbonate anion. Our results explain why, despite a great effort devoted to modify the chemical composition of the cathode, a substantial increase in the MCFC performance has not been observed, and the in-situ oxidized nickel remains state-of-the-art cathode material.

Authors

I am an author on this paper
Click your name to claim this paper and add it to your profile.

Reviews

Primary Rating

4.8
Not enough ratings

Secondary Ratings

Novelty
-
Significance
-
Scientific rigor
-
Rate this paper

Recommended

Article Chemistry, Physical

Recycling electronic scrap to make molten carbonate fuel cell cathodes

Jaroslaw Milewski, Karol Cwieka, Arkadiusz Szczesniak, Lukasz Szablowski, Tomasz Wejrzanowski, Jakub Skibinski, Olaf Dybinski, Aleksandra Lysik, Arkadiusz Sienko, Pawel Stanger

Summary: The study explores the possibility of enhancing the manufacturing process of MCFC cathodes by utilizing precious, semi-precious, and rare earth metals obtained from waste electric and electronic equipment (WEEE). As MCFC components are not sensitive to ceramic and metal impurities, the addition of noble metals recovered from WEEE as catalysts is economically viable. Experimental research demonstrates the positive impact of using 20% recycled electronic scrap in fabricating MCFC cathodes, with powder marked as 4/1 showing superior performance at 550 degrees C compared to the reference cell.

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY (2023)

Article Materials Science, Multidisciplinary

Ab-initio calculation of point defect equilibria during heat treatment: Nitrogen, hydrogen, and silicon doped diamond

Mubashir Mansoor, Mehya Mansoor, Maryam Mansoor, Ammar Aksoy, Sinem Nergiz Seyhan, Betul Yildirim, Ahmet Tahiri, Nuri Solak, Kursat Kazmanli, Zuhal Er, Kamil Czelej, Mustafa Urgen

Summary: This study investigates the formation energy and equilibrium state of point defects in diamond through theoretical calculations. Monolithic-Kroger-Vink diagrams are plotted to represent the relationship between defect concentrations and heat treatment parameters. The method successfully predicts experimental data and provides new insights for the heat treatment of diamond and other materials.

DIAMOND AND RELATED MATERIALS (2022)

Article Chemistry, Physical

A Comparative Study of Aluminium and Titanium Warm Sprayed Coatings on AZ91E Magnesium Alloy

Rafal Maksymilian Molak, Bartosz Moronczyk, Ewa Ura-Binczyk, Zbigniew Pakiela, Wojciech Zorawski, Krzysztof Jan Kurzydlowski, Seiji Kuroda

Summary: Aluminium (Al) and titanium (Ti) coatings were applied on AZ91E magnesium alloy using a low-pressure warm spray method with different nitrogen flow rates (NFR). The effects of NFR on coating microstructure and physical properties were systematically studied. The results showed that decreasing NFR resulted in denser and more compact coatings, but also increased powder oxidation. Al coatings exhibited lower hardness and wear resistance compared to Ti coatings, but were more suitable for corrosion protection due to their low porosity and high compactness.

MATERIALS (2022)

Article Chemistry, Physical

Influence of Diatomaceous Earth Particle Size on Mechanical Properties of PLA/Diatomaceous Earth Composites

Marta Dobrosielska, Renata Dobrucka, Dariusz Brzakalski, Milosz Frydrych, Paulina Kozera, Monika Wieczorek, Marek Jalbrzykowski, Krzysztof J. Kurzydlowski, Robert E. Przekop

Summary: Fractionation of diatomaceous earth allowed for obtaining a range of particle sizes, with modification using the smallest particles resulting in improved impact strength, melt flow rate, and elasticity of the PLA composite material.

MATERIALS (2022)

Review Biotechnology & Applied Microbiology

Role of catalyst supports in biocatalysis

Soumya Koippully Manikandan, Dimitrios A. Giannakoudakis, Jovana R. Prekodravac, Vaishakh Nair, Juan Carlos Colmenares

Summary: This article focuses on the use of material supports for developing immobilized biocatalysts in various applications. Different types of materials, including organic, inorganic, and composites, have been shown to be effective for supporting the immobilization of enzymes and microbial cells. Nanomaterial supports offer advantages such as large surface area and comfortable compartments for immobilization. The choice of catalyst support depends on the interaction between the material and the enzyme or microbial cell.

JOURNAL OF CHEMICAL TECHNOLOGY AND BIOTECHNOLOGY (2023)

Article Polymer Science

Biocomposites Based on Polyamide 11/Diatoms with Different Sized Frustules

Marta Dobrosielska, Renata Dobrucka, Paulina Kozera, Rafal Kozera, Marta Kolodziejczak, Ewa Gabriel, Julia Glowacka, Marek Jalbrzykowski, Krzysztof J. Kurzydlowski, Robert E. Przekop

Summary: Amorphous diatomite was used as a filler for polyamide 11 to produce biocomposites with improved mechanical properties. The diatomite particles were fractionated by sedimentation to obtain powders with different particle size distributions. Biocomposites with varied filler content were tested for mechanical properties and analyzed for particle size distribution, filler dispersion, and thermal parameters. The results showed that biocomposites modified with diatomaceous earth exhibited higher mechanical strength, especially with larger amounts of filler. The sedimentation process used in this study can be applied on an industrial scale for the production of biocomposites.

POLYMERS (2022)

Article Physics, Applied

Two dimensional LiMgAs: A topological quantum catalyst for hydrogen evolution reaction

Raghottam M. Sattigeri, Prafulla K. Jha, Piotr Spiewak, Krzysztof J. Kurzydlowski

Summary: This study demonstrates that the conducting edge states in 2D topological insulators can facilitate excellent catalytic response, opening up possibilities for high-performance and efficient catalysts.

APPLIED PHYSICS LETTERS (2022)

Article Biochemistry & Molecular Biology

Study on Biogenic Spindle-Shaped Iron-Oxide Nanoparticles by Pseudostaurosira trainorii in Field of Laser Desorption/Ionization Applications

Piya Roychoudhury, Aleksandra Golubeva, Przemyslaw Dabek, Oleksandra Pryshchepa, Gulyaim Sagandykova, Pawel Pomastowski, Michal Gloc, Renata Dobrucka, Krzysztof Kurzydlowski, Boguslaw Buszewski, Andrzej Witkowski

Summary: In this study, Pseudostaurosira trainorii mediated biosynthesized iron-oxide nanoparticles (IONPs) were used as nanostructures to assist ionization and desorption in laser desorption/ionization mass spectrometry (LDI-MS). These biogenic IONPs showed high catalytic properties and sensitivity towards small molecules, demonstrating their potential application in future nanobiotechnology and preparation of NALDI plates.

INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES (2022)

Article Physics, Condensed Matter

Stress-induced changes in phonon frequencies of ZrSiO4: Infrared spectroscopy-based pressure sensor

Mubashir Mansoor, Mehya Mansoor, Maryam Mansoor, Zuhal Er, Kamil Czelej, Mustafa Uergen

Summary: Functional materials for high-pressure transduction are limited, making them highly sought after. Zirconium silicate has been suggested as a Raman spectroscopic pressure sensor, as hydrostatic pressures greatly influence its Raman shifts. However, there are numerous challenges in mass applications of Raman-based sensor technology. In addition, we found that ZrSiO4 exhibits pressure-dependent infrared spectra and its IR peaks are sensitive to shear stresses and non-hydrostatic pressures, making it a unique sensor for determining various mechanical stresses through IR spectroscopy.

SOLID STATE COMMUNICATIONS (2022)

Article Chemistry, Multidisciplinary

Exceptional Sorption of Heavy Metals from Natural Water by Halloysite Particles: A New Prospect of Highly Efficient Water Remediation

Michal Stor, Kamil Czelej, Andrzej Krasinski, Leon Gradon

Summary: Halloysite particles, with their unique multilayer nanostructure, are demonstrated as highly efficient sorbent of heavy metals. Various purification methods were applied to obtain a developed structure. DFT calculations and experimental results confirm the high sorption potential of modified halloysite towards heavy metals.

NANOMATERIALS (2023)

Article Materials Science, Multidisciplinary

Formation of ReS2/ReO3 semiconductor-metal heterostructure boosts electrocatalytic performance of pristine ReS2 nanoparticles in hydrogen evolution reaction

Lukasz Werner, Zuzanna Bojarska, Marta Mazurkiewicz-Pawlicka, Kamil Czelej, Boguslaw Mierzwa, Lukasz Makowski

Summary: This study presents a novel and facile synthesis method for ReS2 nanoparticles through wet chemical synthesis and annealing. The crystallinity and phase composition of the nanoparticles can be tuned by controlling the process parameters. The synthesized nanoparticles exhibit superior electrocatalytic hydrogen generation performance compared to commercially available ReS2, which can be explained by the formation of ReS2/ReO3 nanocomposites where a small fraction of metallic ReO3 decorates ReS2 nanoparticles. Density functional theory calculations provide insights into the electronic structure and the beneficial impact of ReO3 on the electrocatalytic performance of ReS2 nanoparticles. These findings have important implications for optimizing the electrocatalytic performance of ReS2 nanoparticles and provide a facile strategy for their efficient synthesis.

APPLIED MATERIALS TODAY (2023)

Article Materials Science, Multidisciplinary

Composition stability of single fcc phase in Cr-Fe-Mn-Ni alloys: First-principles prediction and experimental validation

Mark Fedorov, Jan S. Wrobel, Witold Chrominski, Grzegorz Cieslak, Magdalena Plocinska, Krzysztof J. Kurzydlowski, Duc Nguyen-Manh

Summary: The relative phase stability of fcc and bcc Cr-Fe-Mn-Ni alloys was studied using density functional theory, cluster expansion (CE), and Monte Carlo (MC) simulations. The CE models enabled the calculation of Gibbs free energies of formation for different compositions, and the MC simulations provided insights into the stability of these alloys at different temperatures. The results obtained were in line with experimental data and helped identify the alloys that are predicted to have a single fcc phase over a wide temperature range.

ACTA MATERIALIA (2023)

Article Engineering, Environmental

Zero carbon footprint hydrogen generation by photoreforming of methanol over Cu/TiO2 nanocatalyst

Karol Cwieka, Zuzanna Bojarska, Kamil Czelej, Dariusz Lomot, Przemyslaw Dziegielewski, Alexey Maximenko, Kostiantyn Nikiforow, Leon Grado, Ming-Yu Qi, Yi-Jun Xu, Juan Carlos Colmenares

Summary: In this study, atomically dispersed Cu on TiO2 composite nanoparticles synthesized by the wet impregnation method were shown to be highly active and selective in hydrogen production by photoreforming of methanol. The photocatalyst exhibited a significant quantum efficiency and clean and sustainable characteristics.

CHEMICAL ENGINEERING JOURNAL (2023)

Article Materials Science, Multidisciplinary

Insights into the high-pressure behavior of solid bromine from hybrid density functional theory calculations

Madhavi H. Dalsaniya, Krzysztof Jan Kurzydlowski, Dominik Kurzydlowski

Summary: Understanding the properties of molecular solids at high pressure is crucial for the development of new solid-state theories. This study applies a hybrid density functional theory approach to simulate the behavior of elemental bromine under high pressure. The results accurately reproduce experimental observations and provide insights into the metallic properties of different phases.

PHYSICAL REVIEW B (2022)

Article Chemistry, Physical

Elastic Properties of Open Cell Metallic Foams-Modeling of Pore Size Variation Effect

Karol Cwieka, Jakub Skibinski

Summary: The elastic properties of open-cell metallic foams are influenced by both relative density and pore size variation. The Young's modulus and Poisson's ratio can be reduced when there is an increase in pore size variation, even with similar porosity.

MATERIALS (2022)

Article Chemistry, Physical

Enhancing catalytic activity of zeolitic octahedral metal oxides through zinc incorporation for ethane oxidative dehydrogenation

Bolun Yu, Denan Li, Qianqian Zhu, Shufan Yao, Lifeng Zhang, Yanshuo Li, Zhenxin Zhang

Summary: This study successfully improved the catalytic activity of a zeolitic octahedral metal oxide by incorporating a single zinc species into its micropore. The zinc incorporation achieved a high ethane conversion rate and ethylene selectivity. Mechanism study showed that the isolated zinc site played a crucial role in activating oxygen and ethane, as well as stabilizing intermediates and transition states.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Unveiling the synergistic effect between the metallic phase and bridging S species over MoS2 for highly efficient nitrogen fixation

Ruoqi Liu, Hao Fei, Jian Wang, Ting Guo, Fangyang Liu, Zhuangzhi Wu, Dezhi Wang

Summary: This work successfully synthesized a high-performing S-enriched MoS2 catalyst for electrocatalytic nitrogen reduction reaction (NRR), demonstrating high activity and selectivity. The synergistic effect of the 1T phase and bridging S22- species was shown to play a positive role in NRR performances, and DFT calculations revealed the mechanism behind the improved performance.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Polymethylhydrosiloxane-modified gas-diffusion cathode for more efficient and durable H2O2 electrosynthesis in the context of water treatment

Pan Xia, Lele Zhao, Xi Chen, Zhihong Ye, Zhihong Zheng, Qiang He, Ignasi Sires

Summary: This study presents a modified gas-diffusion electrode (GDE) for highly efficient and stable H2O2 electrosynthesis by using trace polymethylhydrosiloxane (PMHS). DFT calculations provide an in-depth understanding of the roles of PMHS functional groups.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Boron-doped rGO electrocatalyst for high effective generation of hydrogen peroxide: Mechanism and effect of oxygen-enriched air

Kwangchol Ri, Songsik Pak, Dunyu Sun, Qiang Zhong, Shaogui Yang, Songil Sin, Leliang Wu, Yue Sun, Hui Cao, Chunxiao Han, Chenmin Xu, Yazi Liu, Huan He, Shiyin Li, Cheng Sun

Summary: Different B-doped rGO catalysts were synthesized and their 2e- oxygen reduction reaction (ORR) performance was investigated. It was found that the 2e- ORR selectivity of B-doped rGO was influenced by the B content and oxygen mass transfer conditions. The synthesized catalyst exhibited high 2e- ORR selectivity and was capable of degrading organic pollutants continuously.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Oxygen vacancies-modified S-scheme heterojunction of Bi-doped La2Ti2O7 and La-doped Bi4Ti3O12 to improve the NO gas removal avoiding NO2 product

Li Lv, Lin Lei, Qi-Wen Chen, Cheng-Li Yin, Huiqing Fan, Jian-Ping Zhou

Summary: Monoclinic phase La2Ti2O7 and orthorhombic phase Bi4Ti3O12 are widely used in photocatalysis due to their layered crystal structure. The electronic structures of these phases play a crucial role in their photocatalytic activity. Heat treatment in a nitrogen atmosphere introduces more oxygen vacancies into the S-scheme heterojunction, leading to enhanced NO removal efficiency.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Understanding the synergistic effect of hydrated electron generation from argon plasma catalysis over Bi2O3/CeO2 for perfluorooctanoic acid dehalogenation: Mechanism and DFT study

Choe Earn Choong, Minhee Kim, Jun Sup Lim, Young June Hong, Geon Joon Lee, Keun Hwa Chae, In Wook Nah, Yeomin Yoon, Eun Ha Choi, Min Jang

Summary: In this study, the synergistic effect between argon-plasma-system (AP) and catalysts in promoting the production of reactive species for water remediation was investigated. By altering the oxygen vacancies concentration of CeO2/Bi2O3 catalyst, the production of hydrated electrons was stimulated for PFOA removal. The results showed that the built-in electric field in the Bi/Ce0.43 interface enhanced electron migration and eaq- generation, leading to improved PFOA removal efficiency.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Ru clusters anchored on N-doped porous carbon-alumina matrix as efficient catalyst toward primary amines via reductive amination

Yushan Wu, Di Xu, Yanfei Xu, Xin Tian, Mingyue Ding

Summary: Efficient synthesis of primary amines from carbonyl compounds was achieved via reductive amination using Ru@NC-Al2O3 as a catalyst, exhibiting high activity and selectivity under mild conditions.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Efficient 1O2 production from H2O2 over lattice distortion controlled spinel ferrites

Yilan Jiang, Peifang Wang, Tingyue Chen, Keyi Gao, Yiran Xiong, Yin Lu, Dionysios D. Dionysiou, Dawei Wang

Summary: By controlling the content of Co and Ni in Co1-xNixFe2O4, the production of O-1(2) from H2O2 can be regulated. NiFe2O4, with the lowest lattice distortion degree, can efficiently produce O-1(2) as the dominant reactive oxygen species. The system also exhibits significant resistance to water matrix interference.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Tailoring the Mo-N/Mo-O configuration in MoO2/Mo2N heterostructure for ampere-level current density hydrogen production

Shuai Feng, Donglian Li, Hao Dong, Song Xie, Yaping Miao, Xuming Zhang, Biao Gao, Paul K. Chu, Xiang Peng

Summary: In this study, MoO2/Mo2N heterostructures were prepared by regulating the coordination of Mo atoms. The electrocatalyst exhibits high current density and excellent stability for hydrogen evolution reaction.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Spin state-tailored tetrahedral and octahedral cobalt centers on millimetric Co-Al oxide catalysts as dual sites for synergistic peroxymonosulfate activation

Jia-Cheng E. Yang, Min -Ping Zhu, Daqin Guan, Baoling Yuan, Darren Delai Sun, Chenghua Sun, Ming-Lai Fu

Summary: This study successfully modulated the electron configuration and spin state of millimetric metal catalysts by adjusting the support curvature radius. The electronic structure-oriented spin catalysis was found to affect the degradation of pollutants, providing new insights for the design and production of highly active, reusable, and stable catalysts.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

Cu nanocrystals coupled with poly (heptazine imide) for synergistically enhanced photocatalytic CH3SH elimination: Facet engineering strengthened electron pump effect

Tao Zhong, Su Tang, Wenbin Huang, Wei Liu, Huinan Zhao, Lingling Hu, Shuanghong Tian, Chun He

Summary: In this study, a highly efficient photocatalyst for the elimination of CH3SH was developed by engineering different crystal facets and coupling them with PHI. Cu (111)/PHI exhibited the highest elimination efficiency and showed good stability and reusability. The enhanced surface electron pump effect and effective adsorption mechanisms were revealed through comprehensive characterizations and DFT calculations.

APPLIED CATALYSIS B-ENVIRONMENT AND ENERGY (2024)

Article Chemistry, Physical

NiSn intermetallic nanoparticles with geometrically isolated Ni sites for selective C-O cleavage of furfural

Feifei Yang, Tianyu Zhang, Jiankang Zhao, Wei Zhou, Nicole J. Libretto, Jeffrey T. Miller

Summary: A Ni3Sn intermetallic nano particle was found to have geometrically isolated Ni sites that could selectively cleave C-O bonds in biomass derivatives. This nano particle showed high activity and selectivity towards 2-methylfuran, unlike Ni nanoparticles that produced other unwanted products derived from the aromatic rings.

APPLIED CATALYSIS B-ENVIRONMENTAL (2024)

Article Chemistry, Physical

Nickel-facilitated in-situ surface reconstruction on spinel Co3O4 for enhanced electrochemical nitrate reduction to ammonia

Lulu Qiao, Di Liu, Anquan Zhu, Jinxian Feng, Pengfei Zhou, Chunfa Liu, Kar Wei Ng, Hui Pan

Summary: This study reveals that surface evolution plays a crucial role in enhancing the electrocatalytic performance of transition metal oxides for electrochemical nitrate reduction reaction (e-NO3RR). Incorporating nickel into Co3O4 can promote surface reconstruction and improve the adsorption of intermediates and reduce energy barriers, leading to enhanced catalytic performance. The reconstructed cobalt-nickel hydroxides (CoyNi1_y(OH)2) on the catalyst's surface serve as the active phase.

APPLIED CATALYSIS B-ENVIRONMENTAL (2024)

Article Chemistry, Physical

Unraveling the discriminative mechanisms for peroxy activation via atomically dispersed Fe-N5 sites for tunable water decontamination

Xinyu Song, Yang Shi, Zelin Wu, Bingkun Huang, Xinhao Wang, Heng Zhang, Peng Zhou, Wen Liu, Zhicheng Pan, Zhaokun Xiong, Bo Lai

Summary: This study explores the discriminative activities and mechanisms for activation of O-O bond in peroxy compounds via single-atom catalysts (SACs) with higher coordination numbers (M-N5). The atomic catalyst (Fe-SAC) with Fe-N5 as the active center was constructed, effectively activating peroxymonosulfate (PMS), peroxydisulfate (PDS), and hydrogen peroxide (H2O2). The study demonstrates the degradation efficiencies of acyclovir are related to the O-O bond length in different peroxy compounds, and reveals the discriminative mechanisms for activation of O-O bond in different Fenton-like systems.

APPLIED CATALYSIS B-ENVIRONMENTAL (2024)

Article Chemistry, Physical

Fe-Mn oxycarbide anchored on N-doped carbon for enhanced Fenton-like catalysis: Importance of high-valent metal-oxo species and singlet oxygen

Yangzhuo He, Hong Qin, Ziwei Wang, Han Wang, Yuan Zhu, Chengyun Zhou, Ying Zeng, Yicheng Li, Piao Xu, Guangming Zeng

Summary: A dual-metal-organic framework (MOF) assisted strategy was proposed to construct a magnetic Fe-Mn oxycarbide anchored on N-doped carbon for peroxymonosulfate (PMS) activation. The FeMn@NC-800 catalyst exhibited superior activity with almost 100% degradation of sulfamethazine (SMZ) in 30 minutes. The study provided insights for the rational design of high-performance heterogeneous catalysts and proposed a novel nonradical-based catalytic oxidation for environmental cleaning.

APPLIED CATALYSIS B-ENVIRONMENTAL (2024)