全文获取类型
收费全文 | 95篇 |
免费 | 6篇 |
国内免费 | 210篇 |
专业分类
化学 | 276篇 |
晶体学 | 1篇 |
力学 | 1篇 |
综合类 | 1篇 |
数学 | 8篇 |
物理学 | 24篇 |
出版年
2022年 | 2篇 |
2021年 | 2篇 |
2020年 | 3篇 |
2018年 | 8篇 |
2017年 | 1篇 |
2016年 | 2篇 |
2015年 | 2篇 |
2014年 | 10篇 |
2013年 | 7篇 |
2012年 | 5篇 |
2011年 | 6篇 |
2010年 | 2篇 |
2009年 | 3篇 |
2008年 | 1篇 |
2007年 | 8篇 |
2006年 | 3篇 |
2005年 | 3篇 |
2004年 | 4篇 |
2003年 | 6篇 |
2002年 | 9篇 |
2001年 | 21篇 |
2000年 | 5篇 |
1999年 | 9篇 |
1998年 | 2篇 |
1997年 | 21篇 |
1996年 | 14篇 |
1995年 | 13篇 |
1994年 | 8篇 |
1993年 | 7篇 |
1992年 | 13篇 |
1991年 | 9篇 |
1990年 | 11篇 |
1989年 | 10篇 |
1988年 | 8篇 |
1987年 | 8篇 |
1986年 | 20篇 |
1985年 | 9篇 |
1984年 | 17篇 |
1983年 | 15篇 |
1981年 | 1篇 |
1978年 | 1篇 |
1975年 | 2篇 |
排序方式: 共有311条查询结果,搜索用时 15 毫秒
21.
Compared to experiment, the adsorption energies, bonding properties, and electronic structure of two different Al2O3/B4C bridge sites with seven different Al2O3 surfaces are investigated by ab initio periodic density functional theory. The Al2O3/B4C ceramic sintered in Ar is synthesized and measured by XRD and TEM. The calculated results reveal that the densification of O_bridge site of Al2O3/B4C surface is better than that of Al_bridge. The Al2O3 (1 1 3)/B4C with O_bridge is the most favorable and stable. The electronic structure shows that the electron hybridization exists between Al, O atoms and C, B atoms. The results indicate that the calculated results are in good agreement with the experiment. 相似文献
23.
Xinde Tang Xiaochao Liang Qian Yang Xinghe Fan Zhihao Shen Qifeng Zhou 《Journal of polymer science. Part A, Polymer chemistry》2009,47(17):4420-4427
Novel AB2‐type amphiphilic block copolymers of poly(ethylene glycol) and poly(N‐isopropylacrylamide), PEG‐b‐(PNIPAM)2, were successfully synthesized through single‐electron transfer living radical polymerization (SET‐LRP). A difunctional macroinitiator was prepared by esterification of 2,2‐dichloroacetyl chloride with poly(ethylene glycol) monomethyl ether (PEG). The copolymers were obtained via the SET‐LRP of N‐isopropylacrylamide (NIPAM) with CuCl/tris(2‐(dimethylamino)ethyl)amine (Me6TREN) as catalytic system and DMF/H2O (v/v = 3:1) mixture as solvent. The resulting copolymers were characterized by gel permeation chromatography and 1H NMR. These block copolymers show controllable molecular weights and narrow molecular weight distributions (PDI < 1.15). Their phase transition temperatures and the corresponding enthalpy changes in aqueous solution were measured by differential scanning calorimetry. As a result, the phase transition temperature of PEG44‐b‐(PNIPAM55)2 is similar to that in the case of PEG44‐b‐PNIPAM110; however, the corresponding enthalpy change is much lower, indicating the significant influence of the macromolecular architecture on the phase transition. This is the first study into the effect of macromolecular architecture on the phase transition using AB2‐type amphiphilic block copolymer composed of PEG and PNIPAM. © 2009 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 47: 4420–4427, 2009 相似文献
24.
A rigorous derivation of the optical theorem (OT) from the conservation of probability flux (CPF) is presented for scattering
on an arbitrary spherically symmetric potential inN-spatial dimensions (ND). The constructed expression for the OT is found to yield the corresponding well-known results for
two- and three-dimensional cases in a rather natural way. The Aharonov-Bohm (AB) effect is considered as a scattering event
of an electron by a magnetic field confined in an infinitely long shielded solenoid and a similar derivation is attempted
for an appropriate optical theorem. Our current understanding of the scattering theory is found to be inadequate for the purpose.
The reason for this is discussed in some detail. 相似文献
25.
26.
《Quaestiones Mathematicae》2013,36(3):323-337
Abstract It is shown that the category CS of closure spaces is a topological category. For each epireflective subcategory A of a topological category X a functor F A :X → X is defined and used to extend to the general case of topological categories some results given in [4], [5] and [10] for epireflective subcategories of the category Top of topological spaces. 相似文献
27.
Poly(ether ketone)s bearing pendent sulfonate groups (SPEK‐x/y/z) have been successfully synthesized via copolyacylation of a presulfonated monomer SBP and two isomeric AB‐type self‐condensable comonomers, that is, 4‐phenoxybenzoic acid (p‐POBA) and 3‐phenoxybenzoic acid (m‐POBA). Proton‐exchange membranes (PEMs) with precisely controlled ion‐exchange capacity (IEC) and high strength can be readily prepared from these ionomers. PEMs prepared from p‐POBA other than m‐POBA exhibit much higher dimensional stability and proton conductivity at elevated temperature above 60 °C, showing prominent isomeric (para vs. meta) effects of polymer structural units. Furthermore, properties of PEMs prepared from p‐POBA are optimized by tuning IEC. SPEK‐1.0/2.2/0 with an IEC of 1.84 mmol g?1 exhibits acceptable swelling, much higher proton conductivity, and lower methanol permeability than commercial Nafion 115, implying potential application in direct methanol fuel cells. © 2013 Wiley Periodicals, Inc. J. Polym. Sci., Part A: Polym. Chem. 2014 , 52, 200–207 相似文献
28.
Two naturally occurring rare 5-oxo β-triketones, AB5046A and AB5046B, were efficiently synthesized in five linear steps with overall yields of 36% and 28%, respectively. The synthetic strategy highlighted the readily preparation of the key intermediate, 3-ethoxy-5-hydroxycyclohex-2-enone, from commercially available phloroglucinol. 相似文献
29.
运用从头计算法,在HF/6-31G^*水平下,全优化计算了7种硝氨四唑衍生物的分子几何和电子结构。结果表明,标题物的四唑环近似为平面构型;2H式中性分子的芳香性大于相应的1H式异构体。5-硝氨-1H四唑分子内氢键使硝氨基与环共面;其余标题物中硝氨基与环垂直。不同水平下的总能量计算表明,标题物中电子相关效应显著;1H式中性分子较2H式的能量高,5-硝氨四唑负离子在三个负离子中最稳定。根据电荷分布阐明了四唑环质子化位置和标题物与金属的配位方式。此外还计算了各标题物的红外光谱及热力学性质。 相似文献
30.
本文用RHF/3-21G^*解析梯度方法研究了溴代类卡宾H2CMBr(M=Na,K)势能面的主要特征, 得到了它们各自的三种平衡构型及两种异构化的过渡态构型, 并用二级微扰方法进行了能量的相关能校正, 计算了振动频率, 以确证平衡构型和过渡态。计算结果表明, 溴代类卡宾H2CMBr(M=N,K))的三元环构型是最稳定的几何构型, 其它的两种构型σ-配合物和p-配合物, 也是势能面上的极值点, 但能量相对较高, 不稳定。本文分析了各构型的特点, 对其化学反应特性进行了评估。 相似文献