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A WDM compatible Edge-to-Edge Self-Routed optical packet switched network that simplifies the optical processing is proposed. The system employs all-optical packet label generation and recognition using coded superstructured Fiber Bragg gratings. 相似文献
3.
Thermodynamics and dynamics of metallic glass formers: their correlation for the investigation on potential energy landscape 总被引:3,自引:0,他引:3
Great progress has been made in basic features of the potential energy landscape (PEL) theoretically. The present work, however, attempts to cast new light on it from experimental aspects. By a survey of experimental data related to thermodynamics or dynamics of metallic glass-forming liquids, it is found that the increased rate of excitation of vibrational entropy at glass transition tends to increase the rate of generation of configurational part. Although for the type of metallic materials a generally positive relationship exists between the density of the energy minima at glass transition and the liquid fragility strength, just as expected, our main attention is paid to the phenomenon of the scattering of the slopes. Analysis shows that the phenomenon results from the different average height of energy barriers between minima near glass transition. Investigation on the PdNiP metallic system indicates that the mismatch entropy is a dominant factor in the barrier height: a large value of it results in low energy barriers. Our previous work on the AlNiCe system gives the support to this finding. 相似文献
4.
Structural Chemistry - Density functional theory (DFT) calculations were employed to study the 5-fluorouracil (5FU) drug interaction strength with perfect and defective forms of boron carbide... 相似文献
5.
Structures of Highly Twisted Amides Relevant to Amide N−C Cross‐Coupling: Evidence for Ground‐State Amide Destabilization 下载免费PDF全文
Dr. Vittorio Pace Prof. Dr. Wolfgang Holzer Guangrong Meng Shicheng Shi Prof. Dr. Roger Lalancette D.Sc. Roman Szostak Prof. Dr. Michal Szostak 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(41):14494-14498
Herein, we show that acyclic amides that have recently enabled a series of elusive transition‐metal‐catalyzed N?C activation/cross‐coupling reactions are highly twisted around the N?C(O) axis by a new destabilization mechanism of the amide bond. A unique effect of the N‐glutarimide substituent, leading to uniformly high twist (ca. 90°) irrespective of the steric effect at the carbon side of the amide bond has been found. This represents the first example of a twisted amide that does not bear significant steric hindrance at the α‐carbon atom. The 15N NMR data show linear correlations between electron density at nitrogen and amide bond twist. This study strongly supports the concept of amide bond ground‐state twist as a blueprint for activation of amides toward N?C bond cleavage. The new mechanism offers considerable opportunities for organic synthesis and biological processes involving non‐planar amide bonds. 相似文献
6.
Dr. Laura Ielo Prof. Dr. Vittorio Pace Prof. Dr. Wolfgang Holzer Md. Mahbubur Rahman Dr. Guangrong Meng Dr. Roman Szostak Prof. Dr. Michal Szostak 《Chemistry (Weinheim an der Bergstrasse, Germany)》2020,26(69):16246-16250
The structure and properties of amides are of tremendous interest in organic synthesis and biochemistry. Traditional amides are planar and the carbonyl group non-electrophilic due to nN→π*C=O conjugation. In this study, we report electrophilicity scale by exploiting 17O NMR and 15N NMR chemical shifts of acyclic twisted and destabilized acyclic amides that have recently received major attention as precursors in N-C(O) cross-coupling by selective oxidative addition as well as precursors in electrophilic activation of N-C(O) bonds. Most crucially, we demonstrate that acyclic twisted amides feature electrophilicity of the carbonyl group that ranges between that of acid anhydrides and acid chlorides. Furthermore, a wide range of electrophilic amides is possible with gradually varying carbonyl electrophilicity by steric and electronic tuning of amide bond properties. Overall, the study quantifies for the first time that steric and electronic destabilization of the amide bond in common acyclic amides renders the amide bond as electrophilic as acid anhydrides and chlorides. These findings should have major implications on the fundamental properties of amide bonds. 相似文献
7.
Dr. Jinqiao Dong Yutong Pan Dr. Heng Wang Dr. Kuiwei Yang Dr. Lingmei Liu Prof. Zhiwei Qiao Yi Di Yuan Shing Bo Peh Dr. Jian Zhang Dr. Leilei Shi Prof. Hong Liang Prof. Yu Han Prof. Xiaopeng Li Prof. Jianwen Jiang Prof. Bin Liu Prof. Dan Zhao 《Angewandte Chemie (Weinheim an der Bergstrasse, Germany)》2020,132(25):10237-10245
The self-assembly of highly stable zirconium(IV)-based coordination cages with aggregation induced emission (AIE) molecular rotors for in vitro bio-imaging is reported. The two coordination cages, NUS-100 and NUS-101, are assembled from the highly stable trinuclear zirconium vertices and two flexible carboxyl-decorated tetraphenylethylene (TPE) spacers. Extensive experimental and theoretical results show that the emissive intensity of the coordination cages can be controlled by restricting the dynamics of AIE-active molecular rotors though multiple external stimuli. Because the two coordination cages have excellent chemical stability in aqueous solutions (pH stability: 2–10) and impressive AIE characteristics contributed by the molecular rotors, they can be employed as novel biological fluorescent probes for in vitro live-cell imaging. 相似文献
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制备了一系列不同La2O3含量(100Fe/2.8Si/nLa,n=0,0.5,1,2,4,原子比)的沉淀铁费-托合成催化剂,通过原位X射线衍射、一氧化碳程序升温还原和N2吸附-脱附等手段对催化剂进行了表征.催化剂费-托反应评价在固定床反应器中进行.结果表明,少量La2O3助剂(La/Fe≤0.01,原子比)的加入显著降低了Fe2O3颗粒大小,增加了催化剂的比表面积和分散度,有利于碳化铁的形成,从而导致费-托合成催化活性的提高.随着La2O3含量的进一步增加(La/Fe≥0.02),催化剂表面大量La2O3的覆盖和LaFeO3化合物的形成降低了铁碳化物的形成,反应活性反而降低.因此,最适宜的La2O3含量为La/Fe=0.01.La2O3的加入提高了甲烷的选择性,抑制了C5+碳氢化合物的形成. 相似文献
10.
N2O-C2H2火焰原子吸收光谱法测试羰基镍粉中的钙 总被引:1,自引:0,他引:1
运用N2O-C2H2火焰原子吸收光谱法测定羰基镍粉中的钙.对方法的火焰条件、酸介质、灯电流与燃烧器高度等进行了试验.试验结果表明,用该方法对样品钙含量进行分析,分析结果的相对标准偏差均小于1.0%(n=6);加标回收率为97.0%~99.0%(n=6).该方法满足实验室的仪器分析质量控制要求. 相似文献