全文获取类型
收费全文 | 887篇 |
免费 | 22篇 |
国内免费 | 4篇 |
专业分类
化学 | 630篇 |
晶体学 | 12篇 |
力学 | 14篇 |
数学 | 76篇 |
物理学 | 181篇 |
出版年
2023年 | 8篇 |
2021年 | 7篇 |
2020年 | 7篇 |
2019年 | 13篇 |
2018年 | 9篇 |
2017年 | 6篇 |
2016年 | 16篇 |
2015年 | 21篇 |
2014年 | 23篇 |
2013年 | 40篇 |
2012年 | 62篇 |
2011年 | 63篇 |
2010年 | 31篇 |
2009年 | 37篇 |
2008年 | 66篇 |
2007年 | 39篇 |
2006年 | 52篇 |
2005年 | 56篇 |
2004年 | 30篇 |
2003年 | 34篇 |
2002年 | 21篇 |
2001年 | 15篇 |
2000年 | 21篇 |
1999年 | 20篇 |
1998年 | 9篇 |
1997年 | 11篇 |
1996年 | 15篇 |
1995年 | 8篇 |
1994年 | 9篇 |
1993年 | 8篇 |
1992年 | 9篇 |
1991年 | 5篇 |
1990年 | 7篇 |
1989年 | 9篇 |
1988年 | 11篇 |
1987年 | 10篇 |
1985年 | 15篇 |
1984年 | 11篇 |
1983年 | 12篇 |
1982年 | 5篇 |
1981年 | 7篇 |
1979年 | 7篇 |
1978年 | 2篇 |
1977年 | 6篇 |
1976年 | 4篇 |
1975年 | 7篇 |
1974年 | 9篇 |
1973年 | 4篇 |
1971年 | 2篇 |
1969年 | 4篇 |
排序方式: 共有913条查询结果,搜索用时 15 毫秒
91.
Theoretical studies of the ground and lowest excited singlet and triplet states of a series of titanium dioxide ring structures, (TiO(2))(2n), n = 3-9, are reported. Calculations are based on many-electron configuration theory, where energies of states and geometrical structures are determined by variational energy minimization. The lowest energy excited states correspond to excitations from oxygen 2p levels to unoccupied 3d orbitals on titanium. For each ring system, two types of excited state solutions are investigated: those that maintain periodic symmetry for individual orbitals and solutions that allow the symmetry to be broken. The latter solutions which correspond to localized states or excitons are found to be significantly lower in energy than the symmetric solutions. We compare the vertical excitation energy of these well-defined geometrical structures with size effects reported in experimental studies. 相似文献
92.
Sanghera N Correia BE Correia JR Ludwig C Agarwal S Nakamura HK Kuwata K Samain E Gill AC Bonev BB Pinheiro TJ 《Chemistry & biology》2011,18(11):1422-1431
The prion protein (PrP) resides in lipid rafts in?vivo, and lipids modulate misfolding of the protein to infectious isoforms. Here we demonstrate that binding of recombinant PrP to model raft membranes requires the presence of ganglioside GM1. A combination of liquid- and solid-state NMR revealed the binding sites of PrP to the saccharide head group of GM1. The binding epitope for GM1 was mapped to the folded C-terminal domain of PrP, and docking simulations identified key residues in the C-terminal region of helix C and the loop between strand S2 and helix B. Crucially, this region of PrP is linked to prion resistance in?vivo, and structural changes caused by lipid binding in this region may explain the requirement for lipids in the generation of infectious prions in?vitro. 相似文献
93.
Maity P Tsunoyama H Yamauchi M Xie S Tsukuda T 《Journal of the American Chemical Society》2011,133(50):20123-20125
A new class of monolayer-protected Au clusters with Au-C covalent bonds (organogold clusters) was synthesized by ligating phenylacetylene (PhC≡CH) to PVP-stabilized Au clusters. Matrix-assisted laser desorption ionization mass spectrometry revealed for the first time a series of stable compositions of the organogold (Au:C(2)Ph) clusters. 相似文献
94.
Shiraki T Dawn A Le TN Tsuchiya Y Tamaru S Shinkai S 《Chemical communications (Cambridge, England)》2011,47(25):7065-7067
A thermo- and light-responsive system consisting of single-walled carbon nanotube and helical polysaccharide modified with poly(N-isopropylacrylamide) side-chains has been developed through supramolecular polymer wrapping. Coagulation of the complex can be induced by the external stimuli, which leads to a catch-and-release action of a porphyrin derivative. 相似文献
95.
Naomi Warashina Masahiro Tsuchiya Kaori Ishimaru Takakazu Kojima 《Journal of Thermal Analysis and Calorimetry》2011,105(2):473-477
Imbalance condensation of diaminophenylbenzimidazole, DAPBI, with terephthaloyl chloride, TPC was conducted for the purpose
of synthesis of macromonomers, expected to be used in syntheses of aromatic polyamides with structural regularities. The products
are soluble in dimethylsulfoxide—d6, and their 1H NMR spectra indicate that all the products are carboxyl-terminated. The
signal of carboxyphenyl linked to chain ends is different from that of terephthaloyl in the 1H NMR spectra. By use of the
ratio of the signal intensity of the former to that of the latter, the number-average degree of polymerization, DP
NMR is determined. With the mole ratio in feed, DP
NMR of the product increases. The TG thermograms of the products are a multistage one. Each stage is classified by temperature
and mass loss at an inflection point. Mass loss of each stage classified by temperature at an inflection point corresponds
to mass fraction of an aromatic amide with a characteristic degree of polymerization, DP, and that is, the DP distribution of the products is roughly estimated from the TG thermograms. The DP distribution of macromonomers influences performance of aromatic polyamides with structural regularities, derived from the
macromonomers. The convenient estimation method of DP distribution by TG is useful in industries of high-performance polymers. To the knowledge, such convenient technique has
never reported. 相似文献
96.
97.
Tsuchiya T Imai H Miyoshi S Glans PA Guo J Yamaguchi S 《Physical chemistry chemical physics : PCCP》2011,13(38):17013-17018
The electronic structure and modification of the local interatomic structure of a reactive sputtered amorphous tantalum oxide (a-TaO(x)) thin film with the variation of oxygen nonstoichiometry, x in a-TaO(x) have been investigated by X-ray absorption spectroscopy (XAS), X-ray photoemission spectroscopy (XPS), Raman scattering spectroscopy, and Rutherford back scattering spectroscopy. A parallel chemical shift of Ta4f(7/2) and O1s core levels observed with the variation of x indicates the Fermi level shift by reduction and oxidation in the framework of the rigid band model. Extended X-ray absorption fine structure (EXAFS) suggests both the increase of average coordination number of the first Ta-O shell in polyhedra and a considerable reduction of the average Ta-O bond length with the increase of x. The relative intensity of Raman shift peaks at 670 cm(-1) and 815 cm(-1), corresponding to Ta-O stretching of TaO(6) octahedra and TaO(5) probably with a pyramidal form, respectively, drastically changes between x = 2.47 to 1.86, suggesting the change in the predominant polyhedron from TaO(6) to TaO(5) with a modification in multiplicity of oxygen by the reorganization of the polyhedral network. 相似文献
98.
Ariga K Ishihara S Izawa H Xia H Hill JP 《Physical chemistry chemical physics : PCCP》2011,13(11):4802-4811
A landmark accomplishment of nanotechnology would be successful fabrication of ultrasmall machines that can work like tweezers, motors, or even computing devices. Now we must consider how operation of micro- and molecular machines might be implemented for a wide range of applications. If these machines function only under limited conditions and/or require specialized apparatus then they are useless for practical applications. Therefore, it is important to carefully consider the access of functionality of the molecular or nanoscale systems by conventional stimuli at the macroscopic level. In this perspective, we will outline the position of micro- and molecular machines in current science and technology. Most of these machines are operated by light irradiation, application of electrical or magnetic fields, chemical reactions, and thermal fluctuations, which cannot always be applied in remote machine operation. We also propose strategies for molecular machine operation using the most conventional of stimuli, that of macroscopic mechanical force, achieved through mechanical operation of molecular machines located at an air-water interface. The crucial roles of the characteristics of an interfacial environment, i.e. connection between macroscopic dimension and nanoscopic function, and contact of media with different dielectric natures, are also described. 相似文献
99.
Kentaro Shinoda Tomohiko Nakajima Tetsuo Tsuchiya 《Applied physics. B, Lasers and optics》2013,113(3):479-484
The epitaxial and polycrystalline growth of lanthanum strontium manganite films on single crystalline strontium titanate and lanthanum aluminate substrates, respectively, under the irradiation with XeCl lasers in the excimer laser-assisted metal organic deposition (ELAMOD) process have been previously reported. In order to investigate the growth phenomena, we monitored the thermal radiation from the sample surfaces irradiated with a pulsed ultraviolet laser in situ with near-infrared sensors. The cooling of the lanthanum strontium manganite films on strontium titanate substrates was significantly slower than that of films on lanthanum aluminate substrates. A similar behavior was also observed by the numerical simulation study. This difference in the cooling decay curves may play an important role in the mode by which crystal growth occurs in the ELAMOD process. 相似文献