全文获取类型
收费全文 | 18073篇 |
免费 | 3390篇 |
国内免费 | 2512篇 |
专业分类
化学 | 10665篇 |
晶体学 | 564篇 |
力学 | 1398篇 |
综合类 | 213篇 |
数学 | 672篇 |
物理学 | 10463篇 |
出版年
2024年 | 22篇 |
2023年 | 142篇 |
2022年 | 369篇 |
2021年 | 494篇 |
2020年 | 551篇 |
2019年 | 539篇 |
2018年 | 563篇 |
2017年 | 667篇 |
2016年 | 835篇 |
2015年 | 700篇 |
2014年 | 860篇 |
2013年 | 2010篇 |
2012年 | 1194篇 |
2011年 | 1225篇 |
2010年 | 1032篇 |
2009年 | 1192篇 |
2008年 | 1118篇 |
2007年 | 1151篇 |
2006年 | 1108篇 |
2005年 | 1009篇 |
2004年 | 931篇 |
2003年 | 832篇 |
2002年 | 681篇 |
2001年 | 537篇 |
2000年 | 551篇 |
1999年 | 469篇 |
1998年 | 361篇 |
1997年 | 318篇 |
1996年 | 310篇 |
1995年 | 277篇 |
1994年 | 280篇 |
1993年 | 265篇 |
1992年 | 230篇 |
1991年 | 164篇 |
1990年 | 139篇 |
1989年 | 126篇 |
1988年 | 135篇 |
1987年 | 82篇 |
1986年 | 87篇 |
1985年 | 62篇 |
1984年 | 61篇 |
1983年 | 20篇 |
1982年 | 51篇 |
1981年 | 43篇 |
1980年 | 29篇 |
1979年 | 35篇 |
1978年 | 24篇 |
1977年 | 19篇 |
1976年 | 14篇 |
1973年 | 26篇 |
排序方式: 共有10000条查询结果,搜索用时 46 毫秒
21.
Dr. Qing Tang 《Chemphyschem》2019,20(4):595-601
Among the widely studied 2D transition metal dichalcogenides (TMDs), MoTe2 has attracted special interest for phase-change applications due to its small 2H-1T′ energy difference, yet a large scale phase transition without structural disruption remains a significant challenge. Recently, an interesting long-range phase engineering of MoTe2 has been realized experimentally by Ca2N electride. However, the interface formed between them has not been well understood, and moreover, it remains elusive how the presence of Ca2N would affect the basal plane reactivity of MoTe2. To address this, we performed density functional theory (DFT) calculations to investigate the potential of tuning the phase stability and chemical reactivity of a MoTe2 monolayer via interacting with Ca2N to form a van der Walls heterostructure. We found that the contact nature at the 2H-MoTe2/Ca2N interface is Schottky-barrier-free, allowing for the spontaneous electron transfer from Ca2N to 2H-MoTe2 to make it strongly n-type doped. Moreover, Ca2N doping significantly lowers the energy of 1T′-MoTe2 and dynamically triggers the 2H-to-1T′ transformation. The Ca2N-induced phase modulation can also be applied to tune the phase energetics of MoS2 and MoSe2. Furthermore, using H adsorption as the testing ground, we also find that the H binding on the basal plane of MoTe2 is enhanced after forming heterostructure with Ca2N, potentially providing basis for surface modification and other related catalytic applications. 相似文献
22.
The first-principles DFT calculations together with microkinetic analysis reveal the complex catalytic mechanism of low-content NO oxidation on CrO2(110) at room temperature. It quantitatively makes clear that CrO2(110) can exhibit considerable activity with the Mars-van-Krevelen mechanism preferred, and the nitrate species serves as the key poisoning species. 相似文献
23.
ABSTRACTThis study computes the potential energy curves of the X1Σ+, A1Π, B1Δ, C1Σ+, and D1Π states of AlO+ cation and the transition dipole moments between them. The orders of the rotationless radiative lifetimes are 10–100?μs for the A1Π state, 1–1000?ms for the B1Δ state, 10?ns for the first well and 100?ns for the second well of the C1Σ+ state, and 1?μs for the D1Π state. Emissions of the B1Δ–A1Π and D1Π–C1Σ+ systems are so weak that they are hardly measured via spectroscopy, the emissions of the C1Σ+–X1Σ+, C1Σ+–A1Π, and D1Π–X1Σ+ systems are so strong that they can be detected readily, and emissions of the A1Π–X1Σ+ and D1Π–A1Π systems can be observed through spectroscopy only by a significant effort. There is a strong great similarity between spontaneous emissions of the A1Π–X1Σ+ system of the AlO+ cation and the A2Π–X2Σ+ system of the AlO radical. The emissions of the A2Π–X2Σ+ system of the AlO radical have been measured in outer space Therefore, it is highly possible that the emissions of the A1Π–X1Σ+ system of the AlO+ cation can be detected in the astrophysical media. 相似文献
24.
The physical mechanisms of roughness-induced transition (RIT) in pressure gradient boundary layers are studied using direct numerical simulations. Recent investigations have examined RIT processes in zero-pressure-gradient boundary layers (Suryanarayanan et al., 2019). The present study uses a vorticity dynamics point of view to examine how these processes are altered by a locally accelerating or decelerating flow that strains the vorticity field and creates a net vorticity flux at the wall. Flow acceleration is imposed on specific streamwise extents of the flow. This provides an understanding about how the fundamental mechanisms in different stages of RIT are affected by pressure gradients. The present results suggest that both lift-up and subsequent amplification of the unsteady perturbations are mitigated by flow acceleration. The effect on lift-up is explained by the compression (i.e. large negative value of the stretching term) of the wall-normal vorticity by negative dv/dy. Consistent with earlier experimental observations on spots and wedges, favorable pressure gradients reduce turbulent wedge spreading and nearly arrest the spreading when sufficiently strong. This result is also explained in terms of vorticity dynamics. 相似文献
25.
Mihyun Kang Michael Moßhammer Philipp Sprüssel 《Random Structures and Algorithms》2020,56(4):1117-1170
Let be the orientable surface of genus and denote by the class of all graphs on vertex set with edges embeddable on . We prove that the component structure of a graph chosen uniformly at random from features two phase transitions. The first phase transition mirrors the classical phase transition in the Erd?s‐Rényi random graph chosen uniformly at random from all graphs with vertex set and edges. It takes place at , when the giant component emerges. The second phase transition occurs at , when the giant component covers almost all vertices of the graph. This kind of phenomenon is strikingly different from and has only been observed for graphs on surfaces. 相似文献
26.
27.
相干anti-Stokes Raman散射(coherent anti-Stokes Raman scattering,CARS)技术作为一种非接触测量手段,已广泛应用于多种发动机模型燃烧室温度测量及地面试验.然而,目前的工作主要集中在稳态燃烧场温度的测量,缺乏用高分辨率的单脉冲来测量瞬变的燃烧火焰温度及组分浓度的研究.基于CARS理论,结合多参数拟合算法,开发了基于MATLAB的CARS光谱计算和拟合程序CARSCF;利用McKenna平面火焰炉在不同工况下进行了温度测量,并与DLR测量结果进行对比,结果显示开发的CARSCF具有较高的测量重复性和准确性;最后将CARS技术应用于测量超燃冲压发动机点火过程中的温度测量,获取了点火过程中的温度.结果显示,在来流Mach数为3的条件下,H2/air点火过程中温度呈现急剧上升然后缓慢下降,而CARS信号则呈现急剧上升然后急剧下降随后又缓慢上升的趋势,并且在点火过程中最高温度为1 511 K. 相似文献
28.
采用施加压力的方法将聚苯硫醚熔体凝固,凝固后获得的聚苯硫醚样品经过降温和卸压后在常温常压下回收. X射线衍射和差示扫描量热分析表明:约20 ms时间的快速压缩过程可以抑制熔体结晶,制备出非晶态聚苯硫醚块材,样品的表面及中心都是非晶态.非晶态聚苯硫醚的玻璃化转变温度和晶化温度分别为318和362 K.常压下的退火实验表明,非晶态聚苯硫醚在425 K等温结晶的产物为正交相晶型.压致凝固法中熔体的凝固不是靠温度变化,而是靠压力变化,样品表面和内部处在一致的温度下同时受压凝固,避免了热传导对非晶尺寸的影响,因此非常有利于获得结构均匀的大尺寸非晶态材料. 相似文献
29.
Pengjin Qin Li-An Wang Prof. Joseph M. O'Connor Prof. Kim K. Baldridge Yifan Li Burak Tufekci Jiyue Chen Prof. Arnold L. Rheingold 《Angewandte Chemie (Weinheim an der Bergstrasse, Germany)》2020,132(41):18114-18121
Triene 6π electrocyclization, wherein a conjugated triene undergoes a concerted stereospecific cycloisomerization to a cyclohexadiene, is a reaction of great historical and practical significance. In order to circumvent limitations imposed by the normally harsh reaction conditions, chemists have long sought to develop catalytic variants based upon the activating power of metal–alkene coordination. Herein, we demonstrate the first successful implementation of such a strategy by utilizing [(C5H5)Ru(NCMe)3]PF6 as a precatalyst for the disrotatory 6π electrocyclization of highly substituted trienes that are resistant to thermal cyclization. Mechanistic and computational studies implicate hexahapto transition-metal coordination as responsible for lowering the energetic barrier to ring closure. This work establishes a foundation for the development of new catalysts for stereoselective electrocyclizations. 相似文献
30.