全文获取类型
收费全文 | 76404篇 |
免费 | 23375篇 |
国内免费 | 17028篇 |
专业分类
化学 | 48014篇 |
晶体学 | 970篇 |
力学 | 5114篇 |
综合类 | 20篇 |
数学 | 9833篇 |
物理学 | 52856篇 |
出版年
2024年 | 470篇 |
2023年 | 693篇 |
2022年 | 895篇 |
2021年 | 729篇 |
2020年 | 926篇 |
2019年 | 1446篇 |
2018年 | 1457篇 |
2017年 | 2060篇 |
2016年 | 2202篇 |
2015年 | 2404篇 |
2014年 | 2227篇 |
2013年 | 4107篇 |
2012年 | 4331篇 |
2011年 | 5897篇 |
2010年 | 9218篇 |
2009年 | 9458篇 |
2008年 | 3287篇 |
2007年 | 2827篇 |
2006年 | 2474篇 |
2005年 | 2875篇 |
2004年 | 3749篇 |
2003年 | 3018篇 |
2002年 | 2830篇 |
2001年 | 3105篇 |
2000年 | 2297篇 |
1999年 | 2541篇 |
1998年 | 2135篇 |
1997年 | 1941篇 |
1996年 | 2282篇 |
1995年 | 2730篇 |
1994年 | 2792篇 |
1993年 | 2870篇 |
1992年 | 2447篇 |
1991年 | 2110篇 |
1990年 | 1755篇 |
1989年 | 1856篇 |
1988年 | 1856篇 |
1987年 | 1144篇 |
1986年 | 1197篇 |
1985年 | 874篇 |
1984年 | 986篇 |
1982年 | 906篇 |
1981年 | 740篇 |
1980年 | 794篇 |
1979年 | 546篇 |
1978年 | 555篇 |
1977年 | 655篇 |
1976年 | 1059篇 |
1973年 | 446篇 |
1972年 | 537篇 |
排序方式: 共有10000条查询结果,搜索用时 31 毫秒
2.
量子自旋液体是最近几年刚被人们证实除铁磁体、反铁磁体之外的第三种磁性类型,因其有望解释高温超导的运行机制、改变计算机硬盘信息存储方式而在物理、材料等领域备受关注。自旋阻挫作为量子自旋液体的最小单元可能是解开量子自旋液体诸多问题的钥匙,所以在磁学、电学研究领域再一次成为人们研究的热点。基于文献报道的三核铜配合物[Cu3(μ3-OH)(μ-OPz)3(NO3)2(H2O)2]·CH3OH(1),我们合成了三维金属有机框架配合物{[Ag(HOPz)Cu3(μ3-OH)(NO3)3(OPz)2Ag(NO3)]·6H2O}n(2)(HOPz=甲基(2-吡嗪基)酮肟),并从自旋阻挫的角度对二者磁性质进行对比和详细分析。磁化率数据表明自旋间有很强的反铁磁相互作用和反对称交换。通过包含各向同性和反对称交换的哈密顿算符对两者磁学数据进行拟合并研究其磁构关系,所获最佳拟合参数为:配合物1:Jav=-426 cm^-1,g⊥=1.83,g∥=2.00;配合物2:Jav=-401 cm^-1,g⊥=1.85,g∥=2.00。 相似文献
3.
4.
Understanding and control of the surface properties such as molecular orientations are of great importance in numerous applications of ionic liquids. However, there remain discrepancies among the previous experimental and theoretical studies on the surface orientation and structures of room temperature ionic liquids(RTIL) systems. In this article, the orientation of 1-butyl-3-methylimidazolium([bmin]) cation at the air/liquid interface of a characteristic RTIL, 1-butyl-3-methylimidazolium hexafluorophosphate([bmim][PF6]), was investigated by the sum frequency generation vibrational spectroscopy(SFG-VS). Detailed polarization and experimental configuration analyses of the SFG-VS spectra showed the possibility of a small spectral splitting in the CH3 symmetric stretching region, which can be further attributed to the probable existence of multiple orientations for the interfacial [bmim] cations. In addition, the(N)–CH3 vibrations were absent, ruling out the prediction by several recent molecular dynamics simulations which state that portions of the [bmim] cations orient with a standing-up(N)–CH3 group at the ionic liquid surface. Hence, new realistic theoretical models have to be developed to reflect the complex nature of the ionic liquid surface. 相似文献
5.
6.
Muhammad Usman Khan Muhammad Yasir Mehboob Riaz Hussain Zainab Afzal Muhammad Khalid Muhammad Adnan 《International journal of quantum chemistry》2020,120(22):e26377
The development of organic electron acceptor materials is one of the key factors for realizing high-performance organic solar cells (OSCs). Nonfullerene electron acceptors, compared to traditional fullerene acceptor materials, have gained much impetus owing to their better optoelectronic tunabilities and lower cost, as well as higher stability. Therefore, 5 three-dimensional (3D) cross-shaped acceptor materials having a spirobifullerene core flanked with 2,1,3-benzothiadiazole are designed from a recently synthesized highly efficient acceptor molecule SF(BR) 4 and are investigated in detail with regard to their use as acceptor molecules in OSCs. The density functional theory (DFT) and time-dependent DFT (TDDFT) calculations have been performed for the estimation of frontier molecular orbital (FMO) analysis, density of states analysis, reorganization energies of electron and hole, dipole moment, open-circuit voltage, photo-physical characteristics, and transition density matrix analysis. In addition, the structure-property relationship is studied, and the influence of end-capped acceptor modifications on photovoltaic, photo-physical, and electronic properties of newly selected molecules ( H1-H5 ) is calculated and compared with reference ( R ) acceptor molecule SF(BR) 4 . The structural tailoring at terminals was found to effectively tune the FMO band gap, energy levels, absorption spectra, open-circuit voltage, reorganization energy, and binding energy value in selected molecules H1 to H5 . The 3D cross-shaped molecules H1 to H5 suppress the intermolecular aggregation in PTB7-Th blend, which leads to high efficiency of acceptor material H1 to H5 in OSCs. Consequently, better optoelectronic properties are achieved from designed molecules H1 to H5 . It is proposed that the conceptualized molecules are superior than highly efficient spirobifullerene core-based SF(BR) 4 acceptor molecules and, thus, are recommended to experiments for future developments of highly efficient solar cells. 相似文献
7.
Summary Carbon deposits on the surface ofRu/Fe2O3 catalysts used in the water-gas shift reaction have been investigated by Auger Electron Spectrometry. A correlation has been
found between the thickness of the carbon deposit and the catalytic activity in WGSR. The carbon deposit covers the metallic
active centers and blocks their contact with reagents. The dotting of the iron oxide support with sodium has been found to
reduce the amount of carbon deposit. . 相似文献
8.
The γcmc values of CTAB-SDS decrease from 63.67 mN/m at 10‡C to 36.38 mN/m at 90‡C, slightly lower than those of either CTAB or SDS.
Correspondingly, the CMC of CTAB-SDS decreases almost by half. The increase of surface activity of CTAB-SDS can be attributed
to the relatively weak electrostatic interaction at high temperature, which is supported by the increase of solubility of
CTAB-SDS with rise in temperature. Catalytic effect on oxidation of toluene derivatives with potassium permanganate follows
the order CTAB-SDS > SDS > CTAB. This is not caused by the dissociative effect of CTAB-SDS with low surface activity at low
temperature, as seen from the fact that almost all oxidative products can be retrieved for different toluene derivatives and
surfactants by mimicking the conditions of reaction. In the emulsifications of toluene derivatives at 90‡C, the time that
turbid water layers of surfactant solutions take to become clear is the same as that of the catalytic effect on oxidation
of toluene derivatives. Thus, it can be inferred that surfactants can improve the oxidation yields of toluene derivatives
by increasing the contact between two reacting phases. 相似文献
9.
Ji-Dong Lou Chun-Ling Gao Li Li Zhi-Gang Fang 《Monatshefte für Chemie / Chemical Monthly》2006,41(10):1071-1074
A new procedure for the selective oxidation of alcohols to the corresponding aldehydes and ketones with potassium permanganate
supported on aluminum silicate at room temperature under solvent-free conditions and shaking is reported. 相似文献
10.
The possibility of realizing SASE Free Election Laser in x-ray waveband with EM-wave wiggler is studied in this paper. SASE effect including saturation length, saturation power and nonlinear process is explored through a 3-D simulation code. A utilization of seed light from laser plasma x-ray is also analyzed, which demonstrates the feature of shortening the interaction length for saturation. The results show that sizeable output power of x-ray laser would be generated with a middle energy electron beam. 相似文献