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71.
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Momoji Kubo Tsuguo Kubota Changho Jung Minako Ando Satoshi Sakahara Kenji Yajima Kotaro Seki Rodion Belosludov Akira Endou Seiichi Takami Akira Miyamoto 《Catalysis Today》2004,89(4):479-493
Recently, we introduced a concept of combinatorial chemistry to computational chemistry and proposed a new method called “combinatorial computational chemistry”, which enables us to perform a theoretical high-throughput screening of catalysts. In the present paper, we reviewed our recent application of our combinatorial computational chemistry approach to the design of new catalysts for high-quality transportation fuels. By using our combinatorial computational chemistry techniques, we succeeded to predict new catalysts for methanol synthesis and Fischer–Tropsch synthesis. Moreover, we have succeeded in the development of chemical reaction dynamics simulator based on our original tight-binding quantum chemical molecular dynamics method. This program realizes more than 5000 times acceleration compared to the regular first-principles molecular dynamics method. Electronic- and atomic-level information on the catalytic reaction dynamics at reaction temperatures significantly contributes the catalyst design and development. Hence, we also summarized our recent applications of the above quantum chemical molecular dynamics method to the clarification of the methanol synthesis dynamics in this review. 相似文献
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Cooperative adaptive cruise control(CACC)vehicles are intelligent vehicles that use vehicular ad hoc networks(VANETs)to share trafc information in real time.Previous studies have shown that CACC could have an impact on increasing highway capacities at high market penetration.Since reaching a high CACC market penetration level is not occurring in the near future,this study presents a progressive deployment approach that demonstrates to have a great potential of reducing trafc congestions at low CACC penetration levels.Using a previously developed microscopic trafc simulation model of a freeway with an on-ramp—created to induce perturbations and trigger stop-and-go trafc,the CACC system s efect on the trafc performance is studied.The results show signifcance and indicate the potential of CACC systems to improve trafc characteristics which can be used to reduce trafc congestion.The study shows that the impact of CACC is positive and not only limited to a high market penetration.By giving CACC vehicles priority access to high-occupancy vehicle(HOV)lanes,the highway capacity could be signifcantly improved with a CACC penetration as low as 20%. 相似文献
75.
Cooperative adaptive cruise control(CACC)vehicles are intelligent vehicles that use vehicular ad hoc networks(VANETs)to share trafc information in real time.Previous studies have shown that CACC could have an impact on increasing highway capacities at high market penetration.Since reaching a high CACC market penetration level is not occurring in the near future,this study presents a progressive deployment approach that demonstrates to have a great potential of reducing trafc congestions at low CACC penetration levels.Using a previously developed microscopic trafc simulation model of a freeway with an on-ramp—created to induce perturbations and trigger stop-and-go trafc,the CACC system s efect on the trafc performance is studied.The results show signifcance and indicate the potential of CACC systems to improve trafc characteristics which can be used to reduce trafc congestion.The study shows that the impact of CACC is positive and not only limited to a high market penetration.By giving CACC vehicles priority access to high-occupancy vehicle(HOV)lanes,the highway capacity could be signifcantly improved with a CACC penetration as low as 20%. 相似文献
76.
J. N. Armor 《Catalysis Letters》2007,114(3-4):115-121
Perspectives are offered for reducing the impact of huge amounts of CO2 produced today from power generation and transportation vehicles. The origins of the dilemma between the world’s increasing
use of hydrocarbons as an energy source and the cogeneration of CO2 which results as a co-product are discussed. Hydrocarbons will provide much of the fuel needs for these major, global industries
for the next 20 years and meet 60% of the world’s energy demand. With the growth of both power generation and transportation
vehicles around the world, CO2 levels will continue to increase in the atmosphere. Renewables such as wind, dams, and biomass will not be able to handle
all the energy demand. Technology breakthroughs are needed to reduce the world’s dependence on fossil fuels, which will be
aggravated by the drive to use more coal. Current approaches for removing CO2 are discussed as well as near term and future options with particular focus on how catalysis can offer some solutions. In
particular, solar photocatalysis based approaches offer a potentially viable energy solution. 相似文献
77.
首先介绍了面向智能交通系统(Intelligent Transportation System,ITS)的无线接入网网络结构和主要业务,对车路协同业务和PTT语音业务进行了分析和建模。然后根据不同业务的特点及QoS需求提出具有针对性的调度方案:对于车路协同业务,采用适应车速的动态调度方法;对于PTT语音业务,采用基于状态转换的调度方法;对于视频和其他对时延不敏感的数据业务,采用缓存请求的调度方式。最后在OPNET平台上对调度方法进行仿真,针对各种ITS业务得出延时、丢包率等性能曲线,验证了算法的有效性,这也为ITS接入网的网络设计提供了参考。 相似文献
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轨道电路断轨态接受端电压阈值的界定是影响断轨检测系统可行性及可靠性的关键因素。针对ZPW-2000A轨道电路的断轨态进行仿真分析,在轨道电路断轨态数学模型的建立中考虑了电气绝缘节的等效阻抗以及补偿电容等单元对轨道电路传输特性的影响,利用分布参数模型法推导得出其传输矩阵参数。并在不同的道床电阻和断轨点条件下,利用Matlab软件仿真分析了ZPW-2000A轨道电路断轨态接受端轨面电压的变化。结果表明道床电阻和断轨点位置是影响轨道电路接受端轨面电压的两个重要因素,随着道床电阻和断轨点的变化,断轨态接受端电压始终存在着一个极大值。该仿真模型的建立及其分析方法为ZPW-2000A轨道电路断轨检测的阈值确定提供了一定的依据。 相似文献
80.
以城市轨道交通站前接轨站和站后折返站为例分析了列车在车站的详细作业过程,提出了车站的抽象模型.基于车站模型设计了列车进路搜索算法,开发了车站列车运行过程仿真系统.该系统可以对城市轨道交通车站进行仿真建模,仿真列车在车站的作业过程,并进行车站通过能力的分析计算. 相似文献