全文获取类型
收费全文 | 89933篇 |
免费 | 16913篇 |
国内免费 | 9180篇 |
专业分类
化学 | 61457篇 |
晶体学 | 921篇 |
力学 | 5752篇 |
综合类 | 513篇 |
数学 | 10113篇 |
物理学 | 37270篇 |
出版年
2024年 | 344篇 |
2023年 | 2043篇 |
2022年 | 3294篇 |
2021年 | 3389篇 |
2020年 | 3930篇 |
2019年 | 3511篇 |
2018年 | 3218篇 |
2017年 | 2870篇 |
2016年 | 4585篇 |
2015年 | 4365篇 |
2014年 | 5323篇 |
2013年 | 6775篇 |
2012年 | 8210篇 |
2011年 | 8403篇 |
2010年 | 5547篇 |
2009年 | 5381篇 |
2008年 | 5784篇 |
2007年 | 5069篇 |
2006年 | 4766篇 |
2005年 | 3827篇 |
2004年 | 2950篇 |
2003年 | 2296篇 |
2002年 | 2109篇 |
2001年 | 1820篇 |
2000年 | 1608篇 |
1999年 | 1843篇 |
1998年 | 1591篇 |
1997年 | 1576篇 |
1996年 | 1563篇 |
1995年 | 1322篇 |
1994年 | 1150篇 |
1993年 | 996篇 |
1992年 | 858篇 |
1991年 | 785篇 |
1990年 | 643篇 |
1989年 | 501篇 |
1988年 | 370篇 |
1987年 | 308篇 |
1986年 | 323篇 |
1985年 | 261篇 |
1984年 | 151篇 |
1983年 | 118篇 |
1982年 | 100篇 |
1981年 | 57篇 |
1980年 | 43篇 |
1979年 | 15篇 |
1976年 | 1篇 |
1974年 | 1篇 |
1957年 | 31篇 |
1922年 | 1篇 |
排序方式: 共有10000条查询结果,搜索用时 15 毫秒
971.
The equilibrium geometries, excitation energies, force constants and vibrational frequencies for seven low-lying electronic states X 1A1, 1B1, 3B1, 1A2, 3A2, 1B2 and 3B2 of dichlorocarbene CCl2 have been calculated at the MRSDCI level with a double-zeta plus polarization basis set. Our calculated equilibrium geometry for the X 1A1 state, excitation energy for X 1A1 → 1B1 and vibrational frequencies for the X 1A1 and 1B1 states are in good agreement with experimental data. The electronic transition dipole moments, oscillator strengths for the 1B1 → X 1A1 and 1B2 → X 1A1 transitions, radiative lifetimes for the 1B1 and 1B1 states are calculated using MRSDCI wavefunctions, predicting results in reasonable agreement with experiment. 相似文献
972.
用DSC研究纯三水铝石溶出动力学 总被引:1,自引:0,他引:1
在DSC上研究了NaOH溶液中合成三水铝石的溶出过程动力学。应用非等温反应动力学模型计算了动力学参数,分析和确定了反应机理。模型计算结果与用DSC测得的结果吻合。 相似文献
973.
The stoichiometric pK
1
*
and pK
2
*
for the ionization of sulfurous acid has been determined from emf measurements in NaCl solutions with varying concentrations of added MgCl2 (m=0.1, 0.2 and 0.3) from I=0.5 to 6.0 molal at 25°C. These experimental results have been treated using both the ion pairing and Pitzer's specific ion-interaction models. The Pitzer parameters for the interaction of Mg2+ with SO2 and HSO
3
–
yielded =0.085±0.004, (0) = 0.35±0.02, (1) = 1.2±0.04, and C = –0.072±0.007. The Pitzer parameters (0) = –2.8±0.4, (1) = 12.9±2.9 and (2) = –2071±57 have been determined for the interactions of Mg2+ with SO
3
2–
. The calculated values of pK
1
*
and pK
2
*
using Pitzer's equations reproduce the measured values to within ±0.04 pK units. The ion pairing model with log KMgSO3=2.36±0.02 and logMgSO3 = 0.1021, reproduces the experimental values of pK
2
*
to ±0.01. These results demonstrate that treating the data by considering the formation of MgSO3 yields a better fit of the experimental measurements with fewer adjustable parameters. With these derived coefficients obtained from the Pitzer equations and the ion pairing model, it is possible to make reliable estimates of the activity coefficients of HSO
3
–
and SO
3
2–
in seawater, brines and marine aerosols containing Mg2+ ions. 相似文献
974.
Yu-Peng Tian Ming-Liang Zhang Zhang-Jun Hu Han-Mei Hu Jie-Ying Wu Xuan-Jun Zhang Sheng-Yi Zhang Xu-Tang Tao Min-Hua Jiang He-Ping Chen Suchada Chantrapromma Hoong-Kun Fun 《Transition Metal Chemistry》2005,30(7):778-785
A new Schiff base 4-[N-hydroxyethyl-N-(methyl)amino]benzaldehyde S-methyl dithiocarbazate (HL, where H is a dissociable proton) and the ruthenium complex [Ru(bpy)2L]PF6 (bpy = 2,2′-bipyridine) have been synthesized. The structural determinations of the ligand and its ruthenium complex, by
X-ray crystallography, show that the ligand is coordinated as a monoanionic bidentate N, S-donor, forming a four-member chelate
ring with a bite angle of 65.91°. The complex shows intense MLCT transitions in the visible region. Fluorescent and electrochemical
properties have been also studied. The complex in DMF solution exhibited a strong two-photon absorption (t.p.a.) at 532 nm
nanosecond laser pulses. The t.p.a. coefficient β, t.p.a. cross-section σ and the third-order optical nonlinearity χ(3) of the complex and the ligand have been determined by the Z-scan technique. 相似文献
975.
Thermodynamic and Equilibrium Composition of Using Iron Oxide as an Oxygen Carrier Nonflame Combustion Technology Analysis in 下载免费PDF全文
本文介绍了一种新的燃烧体系--熔融盐循环热载体无烟燃烧技术。这种燃烧体系杜绝环境污染气体NOx和CO2的排放,可以实现真正零排放的目标。计算了以Fe2O3作为氧载体的无烟燃烧体系的热力学参数。用最小吉布斯自由能原则,分析了Fe2O3与CH4的平衡组成。分析表明,如果要想在产物中产生高纯度的CH4完全氧化产物CO2和H2O,Fe2O3与CH4必须达到高摩尔比,如果Fe2O3的量不足,就会产生较多的部分氧化产物如CO,H2甚至C 相似文献
976.
Hu H Qiao M Xie F Fan K Lei H Tan D Bao X Lin H Zong B Zhang X 《The journal of physical chemistry. B》2005,109(11):5186-5192
The desulfurization of thiophene on Raney Ni and rapidly quenched skeletal Ni (RQ Ni) has been studied in ultrahigh vacuum (UHV) by X-ray photoelectron spectroscopy (XPS). The Raney Ni or RQ Ni can be approximated as a hydrogen-preadsorbed polycrystalline Ni-alumina composite. It is found that thiophene molecularly adsorbs on Raney Ni or RQ Ni at 103 K. At 173 K, thiophene on alumina is desorbed, while thiophene in direct contact with the metallic Ni in Raney Ni undergoes C-S bond scission, leading to carbonaceous species most probably in the metallocycle-like configuration and atomic sulfur. On RQ Ni, the temperature for thiophene dissociation is about 100 K higher than that on Raney Ni. The lower reactivity of RQ Ni toward thiophene is tentatively attributed to lattice expansion of Ni crystallites in RQ Ni due to rapid quenching. The existence of alumina and hydrogen may block the further cracking of the metallocycle-like species on Raney Ni and RQ Ni at higher temperatures, which has been the dominant reaction pathway on Ni single crystals. By 473 K, the C 1s peak has disappeared, leaving nickel sulfide on the surface. 相似文献
977.
本非水电池体系由Li负极、多孔石墨电极和电解质溶液组成;电解质溶液由无机溶剂POCl_3(或有机溶剂硝基苯)和溶解在该溶剂中的活性物质(KIBr_2)及支持电解质构成。该电池体系的开路电压为8.50伏左右,放电性能良好,可望在实际中得到应用。此外,对电池体系的反应机理也作了初步的探讨。 相似文献
978.
979.
980.
Yu Lin Ting Xie Baochang Cheng Baoyou Geng Lide Zhang 《Chemical physics letters》2003,380(5-6):521-525
Ordered NiO nanowire arrays embedded in anodic alumina membranes have been prepared by using an electrochemical deposition method. After annealing at 300 °C, the NiO nanowire arrays were characterized using SEM, TEM, SAED, and XRD. SEM and TEM observations reveal that these nanowires are dense, continuous and arranged roughly parallel to one another. XRD and SAED analysis together indicate that these NiO nanowires crystallize with a polycrystalline structure. The optical absorption band gap of NiO nanowire arrays is 3.74 eV, and no obvious blue shift or red shift with respect of that of the bulk NiO can be observed. 相似文献