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CaH2-promoted activity of Ni-carbonate interface for CO2 methanation

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Journal of Energy Chemistry 2025年第1期100卷 522-532页

作者： Jin-Peng Wang Guo-Cui Mao Hui-Lin Jiang Bao-Xia Dong Yun-Lei Teng School of Chemistry and chemical Engineering Yangzhou University

Transition metal-carbonate interfaces often act as active sites in heterogeneous catalytic *** interface between transition metal and metal carbonate exhibits a dynamic equilibrium during the CO2hydrogenation reaction,involving surface carbonate hydrogenation and ***,there have been few reports on engineering the activity of the interface between transition metal and alkaline earth metal carbonate for catalytic *** work demonstrated that the incorporation of CaH2in Ni/CaCO3enhances the CO2methanation activity of the *** CO2conversion for Ni/CaH2-CaCO3reached 68.5%at 400°C,which was much higher than that of the Ni/CaCO3（31.6%） and Ni/CaH2-CaO （42.4%） ***,the Ni/CaH2-CaCO3catalysts remained stable during the stability test for 24 h at 400°C and 8 *** research revealed that CaH2played a crucial role in promoting the activity of the Ni-carbonate interface for ***2could modify the electronic structure of Ni and tune the structural properties of CaCO3to generate medium basic sites （OH groups）,which are favorable for the activation of H2and ***-situ Fourier transform infrared spectroscopy （FTIR） analysis combined with density functional theory calculations demonstrated that CO2activation occurs at the hydroxyl group （OH） on the CaH2-modified Ni-carbonate surface,leading to the formation of CO3H****,our study has confirmed that CO2methanation over the Ni/CaH2-CaCO3catalysts proceeds via the formate pathway.

关键词： Metal hydride Ni catalysts Carbonate Metal-carbonate interface

A surface engineering strategy for the stabilization of zinc metal anodes with montmorillonite layers toward long-life rechargeable aqueous zinc ion batteries

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Journal of Energy Chemistry 2025年第1期100卷 94-105页

作者： Wenbo Wang Ruifeng Xu Xu Zhang Peiyu Wang Bao Yang Bingjun Yang Juan Yang Kailimai Su Pengjun Ma Yanan Deng Xianfeng Fan Wanjun Chen Key Laboratory for Electronic Materials College of Electrical Engineering Northwest Minzu University Resource Chemistry and Energy Materials Research Center State Key Laboratory of Solid Lubrication Lanzhou Institute of Chemical Physics Chinese Academy of Sciences University of Chinese Academy of Sciences Institute for Materials and Processes School of Engineering University of Edinburgh

Rechargeable aqueous zinc-ion batteries （AZIBs） exhibit appreciable potential in the domain of electrochemical energy ***,there are serious challenges for AZIBs,for instance zinc dendrite growth,hydrogen evolution reaction （HER）,and corrosion side ***,we propose a surface engineering modification strategy for coating the montmorillonite （MMT） layer onto the surface of the Zn anode to tackle these issues,thereby achieving high cycling stability for rechargeable *** results reveal that the MMT layer on the surface of the Zn anode is able to provide ordered zincophilic channels for zinc ions migration,facilitating the reaction kinetics of zinc *** functional theory（DFT） calculations and water contact angle （CA） tests prove that MMT@Zn anode exhibits superior adsorption capacity for Zn2+and better hydrophobicity than the bare Zn anode,thereby achieving excellent cycling ***,the MMT@Zn||MMT@Zn symmetric cell holds the stable cycling over 5600 h at 0.5 mA cm-2and 0.125 m A h cm-2,even exceeding 1800 h long cycling under harsh conditions of 5 m A cm-2and 1.25 m A h *** MMT@Zn||V2O5full cell reaches over 3000 cycles at 2 A g-1with excellent rate ***,this surface engineering modification strategy for enhancing the electrochemical performance of AZIBs represents a promising application.

关键词： Surface engineering strategy Montmorillonite layer Protection mechanism of Zn anode Cycling stability Aqueous zinc ion batteries

Structural,electronic,magnetic and optical properties of neodymium chalcogenides using LSDA+U method

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Journal of Semiconductors 2012年第8期33卷 9-14页

作者： A Shankar D P Rai Sandeep R K Thapa Condensed Matter theory group Department of PhysicsMizoram UniversityAizawlMizoram-796004India

We have studied the electronic, magnetic and optical properties of neodymium chalcogenides by performing LSDA＋ U and full potential linearized augmented plane wave （FP-LAPW） method. The electronic structure calculation shows that the electronic states in Nd-chalcogenides were mainly contributed by Nd-4f electrons near Fermi energy and 3p, 4p and 5p state electrons of X （S, Se and Te）, respectively. We have also studied the absorption of light via the imaginary parts of the dielectric function of Nd-chalcogenides.

关键词： DFT DOS magnetic moment U

Boosting hydrocarbon conversion via Cu-doping induced oxygen vacancies on CeO2 in CO2 electroreduction

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Journal of Energy Chemistry 2025年第1期100卷 66-76页

作者： Lei Xue Tong Shi Chenhui Han Heng Zhang Fenrong Liu Haorun Li Yan Wang Xiaojun Gu Shanghong Zeng Inner Mongolia Key Laboratory of Chemistry and physics of Rare Earth Materials School of Chemistry and Chemical Engineering Inner Mongolia University State Key Laboratory of Coal Conversion Institute of Coal Chemistry Chinese Academy of Sciences Institute of Catalysis Department of Chemistry Zhejiang University National Key Laboratory of Baiyunobo Rare Earth Resource Research and Comprehensive Utilization Baotou Research Institute of Rare Earths

Conversion of CO2back to hydrocarbons is the most direct way of closing the“carbon cycle”,and its significance is further enlarged if this process is driven by renewable energies such as ***,precisely controlling the product selectivity towards hydrocarbons against the competitive hydrogen evolution remains challenging,especially for Cu-based ***,we report a novel defect engineering strategy,by which Cu-doping-induced oxygen vacancies on CeO2nanorods were effectively created,with adjustable vacancy/Cu *** resulting optimum catalyst shows up to 79% catalytic current density to hydrocarbons （excluding CO）,with 49% faradaic efficiency to *** and density functional theory unveil that the ratio between oxygen vacancy and Cu affects significantly the formation of*CHO and activation of H2O,which leads to the following deep hydrogenation to *** findings may spur new insights for designing and developing more controllable chemical process relevant to CO2utilization.

关键词： Oxygen vacancy Hydrocarbon production Reaction mechanism

Scheme for Remote Implementation of Partially Unknown Quantum Operation of Two Qubits in Cavity QED

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Communications in Theoretical physics 2008年第11期50卷 1233-1236页

作者： QIU Liang WANG An-Min Quantum theory group Department of Modern Physics University of Science and Technology of China Hefei 230026China

By constructing the recovery operations of the protocol of remote implementation of partially unknownquantum operation of two qubits[An-Min Wang:***.A 74(2006)032317]with two-qubit Cnot gate and singlequbit logic gates,we present a scheme to implement it in cavity ***-lived Rydberg atoms are used as qubits,and the interaction between the atoms and the field of cavity is a nonresonant ***,we analyze the experimentalfeasibility of this scheme.

关键词： remote implementation cavity QED partially unknown quantum operation

Super Gaussian enhancers in the Schwinger mechanism

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Communications in Theoretical physics 2020年第1期72卷 81-88页

作者： Ibrahim Akal theory group DESY 22607 HamburgGermany

We study the Schwinger mechanism in the presence of an additional uniformly oriented,weak super Gaussian of integer order 4 N+*** the worldline approach,we determine the relevant critical points to compute the leading order exponential factor *** show that increasing the parameter N gives rise to a strong dynamical *** N=2,this effect turns out to be larger compared to a weak contribution of the Sauter *** higher orders,specifically,for the rectangular barrier limit,i.e.N→∞,we approach the Lorentzian case as an upper *** the mentioned backgrounds significantly differ in Minkowski spacetime,we show that the found coincidence applies due to identical reflection points in the Euclidean instanton *** addition,we also treat the background in perturbation theory following recent *** doing so,we show that the parameter N determines whether the weak contribution behaves perturbatively or nonperturbatively with respect to the field strength ratio,and,hence,reveals an interesting dependence on the background *** particular,we show that for backgrounds,for which higher orders in the field strength ratio turn out to be relevant,a proposed integral condition is not *** view of these findings,the latter may serve as an indicator for the necessity for higher-order contributions.

关键词： quantum field theory nonperturbative phenomena instantons Schwinger effect semiclassics

Determination of Internal Controls for Quantitative Gene Expression of Isochrysis zhangjiangensis at Nitrogen Stress Condition

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Journal of Ocean University of China 2016年第1期15卷 137-144页

作者： WU Shuang ZHOU Jiannan CAO Xupeng XUE Song Marine Bioproducts Engineering group Dalian Institute of Chemical PhysicsChinese Academy of Sciences

lsochrysis zhangfiangensis is a potential marine microalga for biodiesel production, which accumulates lipid under ni- trogen limitation conditions, but the mechanism on molecular level is veiled. Quantitative real-time polymerase chain reaction （qPCR） provides the possibility to investigate the gene expression levels, and a valid reference for data normalization is an essential prerequisite for firing up the analysis. In this study, five housekeeping genes, actin （ACT）, α-tubulin （TUA）, β-tubulin （TUB）, ubiquitin （UBI）, 18S rRNA （18S） and one target gene, diacylglycerol acyltransferase （DGAT）, were used for determining the reference. By analyzing the stabilities based on calculation of the stability index and on operating the two types of software, geNorm and bestkeeper, it showed that the reference genes widely used in higher plant and microalgae, such as UBI, TUA and 18S, were not the most stable ones in nitrogen-stressed 1. zhangjiangensis, and thus are not suitable for exploring the mRNA expression levels under these experi- mental conditions. Our results show that ACT together with TUB is the most feasible internal control for investigating gene expres- sion under nitrogen-stressed conditions. Our findings will contribute not only to future qPCR studies of/. zhangfiangensis, but also to verification of comparative transcriptomics studies of the microalgae under similar conditions.

关键词： Chrysophyta Isochrysis zhang/iangensis nitrogen deficiency lipid accumulation reference gene selection

DNA sequence representation by trianders and determinative degree of nucleotides

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Journal of Zhejiang University-Science B(Biomedicine & Biotechnology) 2005年第8期6卷 743-755页

作者： DUPLIJ Diana DUPLIJ Steven Institute of Molecular Biology and Genetics Kiev 03143 UkraineTheory Group Nuclear Physics LaboratoryKharkov National UniversityKharkov 61077 Ukraine

A new version of DNA walks, where nucleotides are regarded unequal in their contribution to a walk is introduced, which allows us to study thoroughly the “fine structure” of nucleotide sequences. The approach is based on the assumption that nucleotides have an inner abstract characteristic, the determinative degree, which reflects genetic code phenomenological prop-erties and is adjusted to nucleotides physical properties. We consider each codon position independently, which gives three separate walks characterized by different angles and lengths, and that such an object is called triander which reflects the “strength” of branch. A general method for identifying DNA sequence “by triander” which can be treated as a unique “genogram” (or “gene passport”) is proposed. The two- and three-dimensional trianders are considered. The difference of sequences fine structure in genes and the intergenic space is shown. A clear triplet signal in coding sequences was found which is absent in the intergenic space and is independent from the sequence length. This paper presents the topological classification of trianders which can allow us to provide a detailed working out signatures of functionally different genomic regions.

关键词： DNA walk Triander Determinative degree Analysis DNA sequences Dystrophin Nucleotide

The Light Regime Effect on Triacylglycerol Accumulation of Isochrysis zhangjiangensis

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Journal of Ocean University of China 2019年第2期18卷 474-480页

作者： FAN Xuran CAO Xupeng CHU Yadong WU Peichun XUE Song Marine Bioengineering group Dalian Institute of Chemical Physics Chinese Academy of Sciences University of Chinese Academy of Sciences

Stress state of microalgal cells is caused under unfavorable conditions such as disordered light regime and depleted nitrogen. The stress state can impair photosynthetic efficiency, inhibit cell growth and result in the accumulation of triacylglycerol(TAG) from protective mechanisms. Continuous light or nitrogen starvation was applied on microalgae and performed effectively on inducing TAG production. To evaluate the light regime effect on inducing TAG production, the effect of different light regimes on nitrogen-starved Isochrysis zhangjiangensis was investigated in this work. The continuous light and nitrogen starvation elevated TAG content of biomass by 73% and 193%, respectively. Furthermore, the TAG accumulation of I. zhangjiangensis cell under nitrogen starvation decreased under aggravated stress from continuous illumination. Our results demonstrated that culturing the cells with 14 L: 10 D light regime under nitrogen starvation is the optimal mode to achieve maximal accumulation of TAG. A recovery in light regime was necessary for I. zhangjiangensis cultivation.

关键词： microalgal cultivation triacylglycerol accumulation light regime Nitrogen starvation