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131.
132.
The directional drifting of particles/molecules with broken symmetry has received increasing attention. Through molecular dynamics simulations, we investigate the effects of various solvents on the time-dependent directional drifting of a particle with broken symmetry. Our simulations show that the distance of directional drift of the asymmetrical particle is reduced while the ratio of the drift to the mean displacement of the particle is enhanced with increasing mass, size, and interaction strength of the solvent atoms in a short time range. Among the parameters considered, solvent atom size is a particularly influential factor for enhancing the directional drift of asymmetrical particles, while the effects of the interaction strength and the mass of the solvent atoms are relatively weaker. These findings are of great importance to the understanding and control of the Brownian motion of particles in various physical, chemical, and biological processes within finite time spans. 相似文献
133.
Dr. Malin Li Dr. Yu Gao Dr. Nan Chen Dr. Xing Meng Prof. Chunzhong Wang Dr. Yaoqing Zhang Dr. Dong Zhang Prof. Yingjin Wei Dr. Fei Du Prof. Gang Chen 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(32):11405-11412
Cu3V2O8 nanoparticles with particle sizes of 40–50 nm have been prepared by the co‐precipitation method. The Cu3V2O8 electrode delivers a discharge capacity of 462 mA h g?1 for the first 10 cycles and then the specific capacity, surprisingly, increases to 773 mA h g?1 after 50 cycles, possibly as a result of extra lithium interfacial storage through the reversible formation/decomposition of a solid electrolyte interface (SEI) film. In addition, the electrode shows good rate capability with discharge capacities of 218 mA h g?1 under current densities of 1000 mA g?1. Moreover, the lithium storage mechanism for Cu3V2O8 nanoparticles is explained on the basis of ex situ X‐ray diffraction data and high‐resolution transmission electron microscopy analyses at different charge/discharge depths. It was evidenced that Cu3V2O8 decomposes into copper metal and Li3VO4 on being initially discharged to 0.01 V, and the Li3VO4 is then likely to act as the host for lithium ions in subsequent cycles by means of the intercalation mechanism. Such an “in situ” compositing phenomenon during the electrochemical processes is novel and provides a very useful insight into the design of new anode materials for application in lithium‐ion batteries. 相似文献
134.
Kailong Wu Tao Zhang Lisi Zhan Dr. Cheng Zhong Prof. Shaolong Gong Prof. Nan Jiang Prof. Zheng‐Hong Lu Prof. Chuluo Yang 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(31):10860-10866
A series of green butterfly‐shaped thermally activated delayed fluorescence (TADF) emitters, namely PXZPM , PXZMePM , and PXZPhPM , are developed by integrating an electron‐donor (D) phenoxazine unit and electron‐acceptor (A) 2‐substituted pyrimidine moiety into one molecule via a phenyl‐bridge π linkage to form a D –π–A–π–D configuration. Changing the substituent at pyrimidine unit in these emitters can finely tune their emissive characteristics, thermal properties, and energy gaps between the singlet and triplet states while maintaining frontier molecular orbital levels, and thereby optimizing their optoelectronic properties. Employing these TADF emitters results in a green fluorescent organic light‐emitting diode (OLED) that exhibits a peak forward‐viewing external quantum efficiency (EQE) close to 25 % and a slow efficiency roll‐off characteristic at high luminance. 相似文献
135.
Liang Yan Jing‐Kun Xu Chao‐Fan Huang Zeng‐Yang He Ya‐Nan Xu Prof. Dr. Shi‐Kai Tian 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(37):13041-13045
A new strategy has been established for the kinetic resolution of racemic allylic alcohols through a palladium/sulfonyl‐hydrazide‐catalyzed asymmetric OH‐substitution under mild conditions. In the presence of 1 mol % [Pd(allyl)Cl]2, 4 mol % (S)‐SegPhos, and 10 mol % 2,5‐dichlorobenzenesulfonyl hydrazide, a range of racemic allylic alcohols were smoothly resolved with selectivity factors of more than 400 through an asymmetric allylic alkylation of monosubstituted hydrazines under air at room temperature. Importantly, this kinetic resolution process provided various allylic alcohols and allylic hydrazine derivatives with high enantiopurity. 相似文献
136.
137.
Waiou Zhao Dahai Xu Weiwei Yan Yushi Wang Nan Zhang 《Biomedical chromatography : BMC》2016,30(4):503-507
Cucurbitacin B (CuB), one of the most abundant forms of cucurbitacins, is a promising natural anticancer drug candidate. Although the anticancer activity of CuB has been well demonstrated, information regarding the pharmacokinetics is limited. A rapid, selective and sensitive UPLC‐MS/MS for CuB was developed and validated using hemslecin A (HeA) as internal standard (IS). Plasma samples were pre‐treated by liquid–liquid extraction with dichloromethane. Separation was achieved on a reversed‐phase C18 column (50 × 4.6 mm, 5 µm) at 35°C using isocratic elution with water–methanol (25:75, v/v) at a flow rate of 0.3 mL/min. The analytes were monitored by a triple quadrupole tandem mass spectrometer with positive electrospray ionization mode. The calibration curve was linear (r > 0.995) in a concentration range of 0.3–100 ng/mL with a limit of quantification of 0.3 ng/mL. Intra‐ and inter‐day accuracy and precision were validated by percentage relative error and relative standard deviation, respectively, which were both lower than the limit of 15%. This assay was successfully applied to a pharmacokinetic study of CuB in Wistar rats. Copyright © 2015 John Wiley & Sons, Ltd. 相似文献
138.
Dr. Yuyang Zhou Assistant Prof. Junli Jia Prof. Xiaomei Wang Dr. Weiqiang Guo Prof. Zhengying Wu Prof. Nan Xu 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(47):16796-16800
Seven luminescent iridium(III) complexes were prepared to investigate the relationships between chemical structures and properties of protein staining. For the first time, the effect of the main ligand, the π conjugation effect of the ancillary ligand, and the charge effect of organometallic complexes on protein staining has been revealed. Most importantly, this study gives the first experimental evidence of the potential applications of charge‐neutral organometallic complexes in protein staining, which could open an avenue of exploiting novel protein staining agents in the future. 相似文献
139.
采用后合成法制备MnOx/Al-SBA-15催化剂, 考察了催化剂的低温NH3选择性催化还原(SCR)NOx的性能. 利用傅里叶透射红外变换(FTIR)光谱、N2吸附-脱附、X射线衍射(XRD)、扫描电镜(SEM)、拉曼光谱(Raman)、X射线光电子能谱(XPS)及NH3程序升温脱附(NH3-TPD)的表征手段, 对催化剂的结构性质和SCR性能进行了系统分析. 结果表明, 适量Al的掺杂能提高MnOx/SBA-15催化剂的SCR活性, 当硅铝摩尔比为50时, 催化剂活性最佳. 表征结果显示, Al掺杂后, 催化剂仍保持良好的骨架结构, 较大比表面、孔容和孔径, 并且Mn在催化剂表面富集, 由低价态转化为高价态, MnO2为催化剂的主要活性相. 此外, Al的掺杂使MnOx在催化剂表面高度分散, 表面酸性增强, 从而提高了催化剂的SCR活性. 相似文献
140.
介绍了一个采用自顶向下、逐步细分的结构化软件设计方法,以Visual C++6.0为软件开发平台设计并实现的自主版权的大数据量遥感图像数字处理系统的算法模块的设计、结构,以及系统实现中采用的关键技术.提出了美国ERDAS图像处理系统在滤波算法的图像边界处理及图像处理后象元值超限处理两方面的不足,同时提出并实现了新的优化方法.实践证明在这两方面的优化更有利于图像分析和信息提取. 相似文献