全文获取类型
收费全文 | 717篇 |
免费 | 86篇 |
国内免费 | 113篇 |
专业分类
化学 | 304篇 |
力学 | 8篇 |
数学 | 382篇 |
物理学 | 222篇 |
出版年
2024年 | 2篇 |
2023年 | 12篇 |
2022年 | 19篇 |
2021年 | 38篇 |
2020年 | 31篇 |
2019年 | 31篇 |
2018年 | 13篇 |
2017年 | 25篇 |
2016年 | 18篇 |
2015年 | 28篇 |
2014年 | 36篇 |
2013年 | 42篇 |
2012年 | 60篇 |
2011年 | 53篇 |
2010年 | 49篇 |
2009年 | 69篇 |
2008年 | 58篇 |
2007年 | 75篇 |
2006年 | 49篇 |
2005年 | 24篇 |
2004年 | 23篇 |
2003年 | 20篇 |
2002年 | 20篇 |
2001年 | 30篇 |
2000年 | 17篇 |
1999年 | 23篇 |
1998年 | 11篇 |
1997年 | 16篇 |
1996年 | 7篇 |
1995年 | 9篇 |
1994年 | 3篇 |
1993年 | 2篇 |
1992年 | 1篇 |
1990年 | 2篇 |
排序方式: 共有916条查询结果,搜索用时 15 毫秒
81.
应用Nd:YAG(Spectra-Physics LAB-170)脉冲激光器输出的355nm紫外激光实现了对甲醇、乙醇及正丙醇的多光子电离,对每一种样品通过质谱技术都观测到了两个质子化团簇离子系列:(R..3OH)nH 和(R1,2,3OH)n(H2O)H (R1,2,3代表CH2、CH2CH2及CH2CH3CH2),结合在HF/STO-3G和B3LYP/6-31G 水平上的从头计算对其反应通道做了分析,发现其产生经过了团簇内部的质子转移反应及离子-分子反应,且质子主要来自于羟基上的氢离子.并结合从头算分析了(R1,2,3OH)nH 的结构,给出了幻数团簇(R1,2,3OH)3H 的构型.同时对(R1,2,3)n(H2O)H 系列只在n值较大时出现做了相应的解释. 相似文献
82.
83.
使一对纠缠的二能级原子之一与单模真空腔场发生共振相互作用,通过选择不同的演化时间,对这个三体系统的其中之一做选择性测量,可调节另外两体的纠缠状态。在不做测量时,研究了在不同的初始状态下,三体纠缠及三体中两两纠缠的演化特性。结果表明,该体系纠缠都呈现周期性的振荡,特别是,通过选择合适的初始状态和演化时间可生成强壮纠缠态———W纠缠态;在特定演化时刻,可使两纠缠原子的纠缠信息完全转化到腔外原子和腔场中去。 相似文献
84.
85.
In this article, a novel method is proposed for investigating the set controllability of Markov jump switching Boolean control networks (MJSBCNs). Specifically, the switching signal is described as a discrete-time homogeneous Markov chain. By resorting to the expectation and switching indicator function, an expectation system is constructed. Based on the expectation system, a novel verifiable condition is established for solving the set reachability of MJSBCNs. With the newly obtained results on set reachability, a necessary and sufficient condition is further derived for the set controllability of MJSBCNs. The obtained results are applied to Boolean control networks with Markov jump time delays. Examples are demonstrated to justify the theoretical results. 相似文献
86.
作为Hom-Leibniz代数胚的代数类比, 本文引入Hom-Leibniz-Rinehart代数的概念. 证明了分裂的正则Hom-Leibniz-Rinehart代数$L$写成$L=U+\sum_{\gamma}I_\gamma$, 其中$U$为极大交换子代数$H$的子空间和$I_\gamma$为$L$的理想, 若$[\gamma]\neq[d]$, 满足$[I_\gamma, I_d]=0$. 随后分别发展了分裂Hom-Leibniz-Rinehart代数的根和权的连通技术.最后研究了紧致的正则Hom-Leibniz-Rinehart代数的结构. 相似文献
87.
以钼酸铵和C3N4为前驱体,利用浸渍法成功制备了高性能MoO3-C3N4复合光催化剂,利用X射线衍射(XRD)、傅里叶红外(FT-IR)、高分辨电镜(HRTEM)及N2吸附-脱附曲线等测试手段对所得MoO3-C3N4光催化剂进行了结构和形貌表征。以可见光下光催化降解甲基橙反应表征MoO3-C3N4的光催化活性。实验结果表明,MoO3-C3N4光催化剂具有非常好的光催化降解性能,且MoO3含量对反应活性产生显著影响。当MoO3含量为1.6%(w/w)时光催化活性最好,其速率常数达到C3N4的50倍。通过研究发现该复合催化剂的高活性来自于其Z型光生载流子传输过程,抑制了光生电子空穴对的复合并延长了引入MoO3产生的载流子的寿命。 相似文献
88.
《Electrochemistry communications》2008,10(11):1748-1751
A simple one-step preparation of gold–platinum electrocatalysts supported on multi-walled carbon nanotubes (MWCNTs) with high utilization is reported. A low Pt loading series of bimetallic AuPt/MWCNTs catalysts were prepared by the improved ethylene glycol reduction method, and then they were compared in terms of the electrocatalytic activity for methanol oxidation using cyclic voltammetry (CV) and chronoamperometry in alkaline solutions. The structure of AuPt/MWCNTs was characterized by the transmission electron microscopy (TEM), X-ray diffraction (XRD) and energy-dispersive X-ray spectroscopy (EDS). The results showed high Pt utilization, uniform AuPt nanoparticles size and good electrocatalytic activity for methanol electro-oxidation. The effect of Au/Pt mass ratio on electrocatalytic activity was also investigated by CV and chronoamperometry. The highest peak current density, lowest onset potential and best anti-poisoning effect for methanol electro-oxidation appeared at the Au/Pt/MWCNTs mass ratio of 2:4:32. 相似文献
89.
Weihua Wang Nana Wang Ping Li Yuxiang Bu Xiaoyan Xie Rui Song 《Theoretical chemistry accounts》2008,121(1-2):21-31
The influences of thioketo substitution on the properties of uracil monomer and dimer and their interactions with Zn2+ have been systematically investigated at the B3LYP/6-311+G*level of theory. Those properties include the structural characteristics, acidities, ionization potentials, and singlet–triplet energy gaps of SU monomers and their dimers, where SU=2-thiouracil, 4-thiouracil, and 2,4-dithiouracil, respectively. Computational results suggest that thioketo substitution leads to an increase in the acidities of the N-H groups for both uracil and its dimer, where the N1–H group is still the most acidic site relative to that of N3–H group. However, the opposite behaviors are true for the ionization potentials and the singlet–triplet energy gaps of uracil monomer and its dimer, suggesting that thiouracils are more susceptible to radiation damage relative to the unsubstituted uracil. For uracil and 2-thiouracil, the corresponding triplet excited-state geometries are predicted to be highly nonplanar compared with the planar geometries of the ground state as well as 4-thiouracil and 2,4-dithiouracil upon triplet excitation. As a rule, the intermolecular H-bonds involving the sulfur atom directly have been influenced more significant than those the oxygen atom directly involved for U::U and SU::SU base pairs upon ionization and excitation. Additionally, Zn2+ binding is expected to lead to an increase in the stability of U::U and SU::SU base pairs. 相似文献
90.
The detailed catalytic mechanisms on transfer hydrogenation of ketones are explored by employing the representative reaction of 3-pentanone and 2-propanol catalyzed by the model complex IrH3[(Me2PC2H4)2NH], derived from the catalyst IrH3[(iPr2PC2H4)2NH], with the aid of the density functional theory calculations. The geometrical transformation from an octahedron to a Y-type involved in the catalytic cycle is also elucidated in terms of molecular theory of transition metal complexes. The trend for the variation of Ir-N bond distance is also analyzed. 相似文献