全文获取类型
收费全文 | 814篇 |
免费 | 53篇 |
国内免费 | 11篇 |
专业分类
化学 | 564篇 |
晶体学 | 3篇 |
力学 | 24篇 |
数学 | 110篇 |
物理学 | 177篇 |
出版年
2023年 | 5篇 |
2022年 | 9篇 |
2021年 | 17篇 |
2020年 | 15篇 |
2019年 | 16篇 |
2018年 | 18篇 |
2017年 | 7篇 |
2016年 | 29篇 |
2015年 | 32篇 |
2014年 | 30篇 |
2013年 | 62篇 |
2012年 | 55篇 |
2011年 | 56篇 |
2010年 | 30篇 |
2009年 | 30篇 |
2008年 | 45篇 |
2007年 | 52篇 |
2006年 | 47篇 |
2005年 | 38篇 |
2004年 | 30篇 |
2003年 | 27篇 |
2002年 | 26篇 |
2001年 | 24篇 |
2000年 | 21篇 |
1999年 | 11篇 |
1998年 | 6篇 |
1997年 | 12篇 |
1996年 | 10篇 |
1995年 | 7篇 |
1994年 | 6篇 |
1993年 | 13篇 |
1992年 | 14篇 |
1991年 | 6篇 |
1990年 | 5篇 |
1989年 | 4篇 |
1988年 | 5篇 |
1987年 | 2篇 |
1986年 | 5篇 |
1985年 | 7篇 |
1984年 | 8篇 |
1983年 | 6篇 |
1980年 | 5篇 |
1979年 | 2篇 |
1978年 | 4篇 |
1974年 | 3篇 |
1973年 | 2篇 |
1969年 | 2篇 |
1968年 | 2篇 |
1898年 | 2篇 |
1897年 | 1篇 |
排序方式: 共有878条查询结果,搜索用时 31 毫秒
1.
da Silva Andre Luis Ferreira Salas Ruben Andres Silva Emilio Carlos Nelli 《Meccanica》2021,56(2):417-437
Meccanica - Fiber reinforced materials are used in assorted engineering application and for this reason, new additive manufacturing technologies have been developed for this type of materials. With... 相似文献
2.
Mariana Weissmann Andres Saul 《Physica C: Superconductivity and its Applications》1991,180(5-6):381-386
An alloy model is proposed for the electronic structure of high-temperature superconductors. It is based on the assumption that holes and extra electrons are localized in small copper-oxygen clusters, that would be the components of such an alloy. This model, when used together with quantum chemical calculations on small clusters, can explain the structure observed in the experimental densities of states of both hole and electron superconductors close to the Fermi energy. The main point is the strong dependence of the energy level distribution and composition on the number of electrons in a cluster. The alloy model also suggests a way to correlate Tc with the number of holes, or extra electrons, and the number of adequate clusters to locate them. 相似文献
3.
Jan Andres Karel Pastor Pavla Šnyrychová 《Journal of Fixed Point Theory and Applications》2007,2(1):153-170
A multivalued version of Sharkovskiĭ’s theorem is formulated for M-maps on linear continua and, more generally, for triangular M-maps on a Cartesian product of linear continua. This improves the main result of [AP1] in the sense that our multivalued
analogue holds with at most two exceptions. A further specification requires some additional restrictions. For instance, 3-
orbits of m-maps imply the existence of k-orbits for all
k ? \mathbbNk \in {\mathbb{N}}
, except possibly for
k ?k \in
{4, 6}. It is also shown that, on every connected linearly ordered topological space, an M-map with orbits of all periods can always be constructed. This demonstrates that Baldwin’s classification of linear continua
in terms of admissible periods [Ba] is useless for multivalued maps. 相似文献
4.
P. Gorria D. Martínez-Blanco R. Iglesias S.L. Palacios M.J. Pérez J.A. Blanco L. Fernández Barquín A. Hernando M.A. González 《Journal of magnetism and magnetic materials》2006
The magnetic properties of Fe–Cu metastable solid solutions have been investigated by means of neutron diffraction and magnetisation measurements. These compounds exhibit ferromagnetic order with Curie temperatures above room temperature for concentrations beyond 40 at% in Fe. The magnetic moment at 5 K can reach values over 2 μB, while the high field susceptibility is similar to that found in FCC–FeNi Invar alloys. These features together with the low values for the linear coefficient for thermal expansion in the ferromagnetic region suggest that magneto-volume anomalies, including Invar behaviour, play a major role in the magnetic properties of this system when the crystal structure is face centred cubic. Such behaviour could be explained using theoretical total-band energy calculations. 相似文献
5.
An attempt is made to correlate the crystal structures of ternary chalcogenides of composition AB2X4 with the cationic radius ratio and a pseudo force-constant involving their electronegativities. The resultant diagram adequately resolves structures based on the types K2SO4, monoclinic, olivine, MnY2S4, Th3P4, and CaFe2O4 but structure types based on spinel, Cr3Se4, and Ag2HgI4 are not resolved. Crystal chemical arguments are used to explain these observations and to advance reasons for the successes and failures of this method for predicting structure types. 相似文献
6.
F. Flores P. L. de Andres F. J. Garcia-Vidal L. Jurczyszyn N. Mingo R. Perez 《Progress in Surface Science》1995,48(1-4):27-38
Physisorption on metal surfaces, and the tunneling currents through the adsorbed species, are calculated using a unified formalism that presents both problems on the same footing. Our method is based on a self-consistent LCAO approach whereby the different interaction parameters defining the bonds, and the tunneling currents, are calculated using the atomic properties of the atomic species forming the interface. Green function methods and the Keldish formalism are used to calculate the different physical properties. We present results for xenon adsorbed on aluminum. 相似文献
7.
Wilfredo Hernndez Evgenia Spodine Andres Vega Rainer Richter Jan Griebel Reinhard Kirmse Uwe Schrder Lothar Beyer 《无机化学与普通化学杂志》2004,630(10):1381-1386
The N‐acyl thiourea complexes bis[N,N‐diethyl‐N′‐(p‐nitrobenzoyl)‐thioureato]copper(II) ( 1a,1b ) and bis(N,N‐diphenyl‐N′‐benzoylthioureato)copper(II) ( 2a,2b ) crystallize in each case in two modifications. X‐ray structural analysis shows that 1a and 1b are cis‐trans isomers. This is very unusual for N‐acyl thioureato complexes because with exception of one platinum(II) complex up to now only cis complexes have been found. In contrast X‐ray structural analysis of both forms 2a and 2b of the other complex shows no cis‐trans pair. Both modifications are cis complexes. In solution both isomers of the copper(II) complexes are observable by EPR spectroscopy. 相似文献
8.
M. T. Iglesias J. Guzmn E. Riande 《Journal of polymer science. Part A, Polymer chemistry》1994,32(13):2565-2576
The synthesis of new unsaturated monomers containing functional groups has been theoretically analyzed by considering a simple kinetic scheme. In the reactions between acetyl and acryloyl chloride with neopentylglycol, it was shown that the comparison between theoretical and experimental results, does not allow us to conclude that the two rate constants controlling the reactions are equivalent. Kinetic experiments of the polymerization of 3-hydroxyneopentyl acrylate were carried out in benzene and 1,4-dioxane solution at different temperatures. Dilatometric techniques and nonlinear least-squares methods were used to obtain kinetic data and to determine the kinetic constants, respectively. The values of $k_p /k_t^{1/2}$ for this monomer were found higher in dioxane than in benzene due, probably, to the fact that in the last solvent the polymerization is heterogeneous. The activation energy, determined by using different values of $k_p /k_t^{1/2}$ was found 7.6 kcal/mol. The stereostructure of the polymers derived from 3-hydroxyneopentyl acrylate and 3-acetoxyneopentyl acrylate was determined by 13C-NMR spectroscopy from the analysis of the resonance signals belonging to the carbonyl groups, obtaining values for the fraction of isotactic dyads in the range 0.36 ± 0.03 for both polymers. Finally, the glass transition temperatures of both polymers, determined calorimetrically, were found 281 and 255 K, respectively. © 1994 John Wiley & Sons, Inc. 相似文献
9.
The determination of reaction paths for enzyme systems remains a great challenge for current computational methods. In this paper we present an efficient method for the determination of minimum energy reaction paths with the ab initio quantum mechanical/molecular mechanical approach. Our method is based on an adaptation of the path optimization procedure by Ayala and Schlegel for small molecules in gas phase, the iterative quantum mechanical/molecular mechanical (QM/MM) optimization method developed earlier in our laboratory and the introduction of a new metric defining the distance between different structures in the configuration space. In this method we represent the reaction path by a discrete set of structures. For each structure we partition the atoms into a core set that usually includes the QM subsystem and an environment set that usually includes the MM subsystem. These two sets are optimized iteratively: the core set is optimized to approximate the reaction path while the environment set is optimized to the corresponding energy minimum. In the optimization of the core set of atoms for the reaction path, we introduce a new metric to define the distances between the points on the reaction path, which excludes the soft degrees of freedom from the environment set and includes extra weights on coordinates describing chemical changes. Because the reaction path is represented by discrete structures and the optimization for each can be performed individually with very limited coupling, our method can be executed in a natural and efficient parallelization, with each processor handling one of the structures. We demonstrate the applicability and efficiency of our method by testing it on two systems previously studied by our group, triosephosphate isomerase and 4-oxalocrotonate tautomerase. In both cases the minimum energy paths for both enzymes agree with the previously reported paths. 相似文献
10.
Chehade KA Andres DA Morimoto H Spielmann HP 《The Journal of organic chemistry》2000,65(10):3027-3033
The posttranslational addition of a farnesyl moiety to the Ras oncoprotein is essential for its membrane localization and is required for both its biological activity and ability to induce malignant transformation. We describe the design and synthesis of a farnesyl pyrophosphate (FPP) analogue, 8-anilinogeranyl pyrophosphate 3 (AGPP), in which the omega-terminal isoprene unit of the farnesyl group has been replaced with an aniline functionality. The key steps in the synthesis are the reductive amination of the alpha,beta-unsaturated aldehyde 5 to form the lipid analogue 6, and the subsequent conversion of the allylic alcohol 7 to the chloride 8 via Ph(3)PCl(2) followed by displacement with [(n-Bu)(4)N](3)HP(2)O(7) to give AGPP (3). AGPP is a substrate for protein farnesyltransferase (FTase) and is transferred to Ras by FTase with the same kinetics as the natural substrate, FPP. AGPP is highly selective, showing little inhibitory activity against either geranylgeranyl-protein transferase type I (GGTase I) (K(i) = 0.06 microM, IC(50) = 20 microM) or squalene synthase (IC(50) = 1000 microM). AGPP is the first efficiently transferable analogue of FPP to be modified at the omega-terminus that provides a platform from which additional analogues can be made to probe the biological function of protein farnesylation. AGPP is the first example of a class of compounds that are alternate substrates for protein isoprenylation that are not inhibitors of squalene synthase. 相似文献