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《International Journal of Hydrogen Energy》2022,47(65):28152-28164
The combustion characteristics of ammonia/methanol mixtures were investigated numerically in this study. Methanol has a dramatic promotive effect on the laminar burning velocity (LBV) of ammonia. Three mechanisms from literature and another four self-developed mechanisms constructed in this study were evaluated using the measured laminar burning velocities of ammonia/methanol mixtures from Wang et al. (Combust.Flame. 2021). Generally, none of the selected mechanisms can precisely predict the measured laminar burning velocities at all conditions. Aiming to develop a simplified and reliable mechanism for ammonia/methanol mixtures, the constructed mechanism utilized NUI Galway mechanism (Combust.Flame. 2016) as methanol sub-mechanism and the Otomo mechanism (Int. J. Hydrogen. Energy. 2018) as ammonia sub-mechanism was optimized and reduced. The reduced mechanism entitled ‘DNO-NH3’, can accurately reproduce the measured laminar burning velocities of ammonia/methanol mixtures under all conditions. A reaction path analysis of the ammonia/methanol mixtures based on the DNO-NH3 mechanism shows that methanol is not directly involved in ammonia oxidation, instead, the produced methyl radicals from methanol oxidization contribute to the dehydrogenation of ammonia. Besides, NOx emission analysis demonstrates that 60% methanol addition results in the highest NOx emissions. The most important reactions dominating the NOx consumption and production are identified in this study. 相似文献
3.
《International Journal of Hydrogen Energy》2022,47(11):7432-7442
The durability of metal plate proton exchange membrane fuel cell (PEMFC) stack is still an important factor that hinders its large-scale commercial application. In this paper, we have conducted a 1000 h durability test on a 1 kW metal plate PEMFC stack, and explored the degradation of the core components. After 1000 h of dynamic load cycles, the voltage decay percentage of the stack under the current densities of 1000 mA cm?2 is 5.67%. By analyzing the scanning electron microscopy (SEM) images, the surfaces of the metal plates are contaminated locally by organic matter precipitated from the membrane electrode assembly (MEA). The SEM images of the catalyst coated membrane (CCM) cross section indicate that the MEA has undergone severe degradation, including the agglomeration of the catalyst layer, and the thinning and perforation of the PEM. These are the main factors that cause the rapid increase in hydrogen crossover flow rate and performance decay of the PEMFC stack. 相似文献
4.
《International Journal of Hydrogen Energy》2022,47(6):3972-3979
The sodium borohydride, NaBH4, hydrolysis mechanism is studied via the H2O/D2O kinetic isotope effect (KIE). This reaction is of importance as NaBH4 is considered as a hydrogen storage material. Nowadays, hydrogen is thought to be one of the most promising and efficient clean energy carriers. In order to control the rate of the hydrogen evolution reaction (HER), one has to understand the mechanism of its production. The H2O/D2O KIE of the reactions of NaBH4 and NaBD4 with water was studied in solutions containing a ratio of H2O/D2O = 1.00. The separation factor, α, of both reactions is α = 5.0 ± 1.0. The rate of the hydrolysis of BD4? in H2O is faster than that of BH4?. The results point out that the rate-determining step in all hydrolysis stages is the H–OH bond scission. 相似文献
5.
《Ceramics International》2021,47(22):31485-31496
Mesoporous SmMnO3/CuMnOx catalyst was prepared by a two-step method using flaky CuMnOx with high specific surface and excellent catalytic ability as the carrier, which was further applied to photothermal synergistic degradation of gaseous toluene. Quantitative analysis of O2-TPD and H2-TPR showed that SmMnO3/CuMnOx exhibited abundant of the surface oxygen species and oxygen vacancies content, which enabled it to convert free oxygen to lattice oxygen more quickly during the reaction, and thus improving the reaction process. I-t and photoluminescence experiments demonstrated the improvement of photogenerated electron and hole separation ability of SmMnO3/CuMnOx catalyst. UV–Vis analysis manifested the full spectral range of absorption. XPS analysis verified the unequal positions of valence band of the two materials, which can facilitate the separation of photogenerated electrons from holes and improve the ability of better electron transfer. SmMnO3/CuMnOx catalyst has higher adsorbed oxygen content and light absorption capacity, which is beneficial to the catalytic oxidation. In situ DRIFTs proved that the oxidation reaction on the catalyst followed the Mars-van Krevelen redox cycle. The VOCs test found that SmMnO3/CuMnOx composite catalyst is with lower onset reaction temperature (T90 = 190 °C, T90, corresponding to 90% conversion) and good mineralization (100% at 275 °C). 相似文献
6.
Fenqi Du Dongmei Yang Yue Sun Yang Jiao Feng Teng Haibo Fan 《Ceramics International》2021,47(4):4963-4971
Ultrawide band gap semiconductor materials have attracted considerable attention in recent years owing to their great potential in the photocatalytic field. In this study, Zn-doped Ga2O3 nanofibers with various concentrations were synthesized via electrospinning; they exhibited a superior photocatalytic degradation performance of rhodamine B dye compared to that of undoped Ga2O3 nanofibers. The Zn dopant replaced Ga sites via replacement doping, which could increase the concentration of oxygen vacancies and lead to enhanced photocatalytic properties. When the Zn concentration increased, a Ga2O3/ZnGa2O4 hybrid structure formed, which could further enhance the photocatalytic performance. The separation of photogenerated carriers due to Zn doping and heterojunctions were the primary causes of the enhanced photocatalytic performance. This study provides experimental data for the fabrication of high-performance photocatalysts based on Ga2O3 nanomaterials. 相似文献
7.
Yunqi Li Jing Li Yang-Gang Wang Xiran Chen Mingtao Liu Zhong Zheng Xihong Peng 《International Journal of Hydrogen Energy》2021,46(24):13273-13282
In this work, density functional theory (DFT) calculations were used to investigate the mechanism of carbon corrosion on nitrogen-doped carbon support. Free energy diagrams were generated based on three proposed reaction pathways to evaluate corrosion mechanisms. The most energetically preferred mechanism on nitrogen-doped carbon was determined. The results show that the step of water dissociation to form #OH was the rate-determining step for gra-G-1N (graphene doped with graphitic N) and pyrr-G-1N (graphene doped with pyrrolic N). As for graphene doped with pyridinic N, the step of C#OC#O formation was critical. It was found that the control of nitrogen concentration was necessary for precisely designing optimized carbon materials. Abundance of nitrogen moieties aggravated the carbon corrosion. When the high potential was applied, specific types of graphitic N and pyridinic N were found to be favorable carbon modifications to improve carbon corrosion resistance. Moreover, the solvent effect was also investigated. The results provide theoretical insights and design guidelines to improve corrosion resistance in carbon support through material modification by inhibiting the adsorption of surface oxides (OH, O, and OOH). 相似文献
8.
《International Journal of Hydrogen Energy》2020,45(55):30994-31008
The proton exchange membrane fuel cell has been widely used for industrial systems; however, its performance gradually degrades during use. Therefore, the study on the performance degradation prediction of fuel cells is helpful to extend its lifespan. In this paper, a novel hybrid approach using a combination of model-based adaptive Kalman filter and data-driven NARX neural network is proposed to predict the degradation of fuel cells. The overall degradation trend (i.e., irreversible degradation process) is captured by an empirical aging model and adaptive Kalman filter. Meanwhile, the detail degradation information (i.e., reversible degradation process) is depicted by the NARX neural network. Moreover, the correlation analysis of the reversible voltage time series is carried out to obtain the number of delays of the NARX neural network based on the autocorrelation function and the partial autocorrelation function. Then, the total degradation prediction is the sum of the overall degradation prediction and the detail degradation prediction. Finally, the prognostic capability of the proposed method is verified by two aging datasets, and the results show the effectiveness and superiority of the proposed method which can provide accurate degradation forecasting and remaining useful life. 相似文献
9.
《能源学会志》2020,93(2):666-678
Coal-fired power plant is the largest anthropogenic mercury source. Active carbon injection technique has been widely used to control the mercury emissions. However, high operation cost limits its development and it is necessary to find other potential mercury sorbents. In this study, raw semi-coke and a series of novel cerium (Ce) modified semi-cokes were synthesized and utilized for removing elemental mercury (Hg0) from simulated flue gas. It is noteworthy that the efficiencies were tested without hydrogen chloride (HCl) in order to evaluate the sorbents efficacy for low-chlorine (Cl) coal. The results show that the modified sorbents exhibited the best performance at 150 °C. The performance of sorbent could be reinforced due to the existence of oxygen (O2), nitric oxide (NO) and HCl. The adverse effect caused by sulfur dioxide (SO2) reduced dramatically after Ce modification. The negative impact of ammonia (NH3) on Hg0 removal in this study could be neglected owing to the tiny concentration of NH3. Raw semi-coke provided sufficient carbon content, which is favorable to mercury adsorption. As Ce loading increased, the carbon structure changed and the crystal of cerium oxide was formed in the modified semi-coke. The mass fraction of cerium oxide on the sorbent was over 4.4% when the concentration of Ce modification solution was higher than 0.2 mol L−1. The redox reaction activity and the oxygen storage ability of Ce3+/Ce4+ gave a huge boost to the performance of modified semi-coke. The addition of Ce also had an impact on the proportion of oxygen species. 相似文献
10.
Ufana Riaz S.M. Ashraf Jyoti Kashyap 《Polymer-Plastics Technology and Engineering》2015,54(17):1850-1870
Research in the field of TiO2-based photocatalysis has gained wide attention to address important energy and environmental problem. Lately, the use of conducting polymers as photosensitizers has proven to immensely enhance photodegradation by exhibiting excellent photocatalytic activity under both ultraviolet light and natural sunlight irradiation which is not possible using semiconductors alone. Considering the unique performance of conducting polymer-based nanocomposites in photocatalysis, the present review provides the recent advances in the development of ultraviolet and visible light-responsive conducting polymer-based TiO2 nanocomposites for their potential application in environmental remediation. This review ends with a summary focusing on the challenges and new dimensions in this still emerging area of research. 相似文献