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排序方式: 共有348条查询结果,搜索用时 31 毫秒
51.
Abstract The non-diffractive vector Bessel beams of an arbitrary order are examined as both the solution to the vector Helmholtz wave equation and the superposition of vector components of the angular spectrum. The transverse and longitudinal intensity components of the vector Bessel beams are analysed for the radial, azimuthal, circular and linear polarizations. The radially and azimuthally polarized beams are assumed to be formed by the axicon polarizers used with the initially unpolarized or linearly polarized light. Conditions in which the linearly polarized Bessel beams can be approximated by the scalar solutions to the wave equation are also discussed. 相似文献
52.
ZdenĚK Slanina Chihiro Miyajima Xiang Zhao Filip Uhlík Ludwik Adamowicz Eiji Obarsawa 《Fullerenes, Nanotubes and Carbon Nanostructures》2013,21(4-5):385-402
Abstract Semiempirical quantum-chemical PM3 calculations are reported for a relatively new class of exohedral metallo-fullerenes - metal-coated or metal-covered fullerenes: C60Mn. The exohedral species were recently observed, however, their geometrical and electronic structure is not known yet. In this paper, relatively-even metal-atom distributions over the fullerene rings are considered - such regular forms are computed for M= Be, Mg, Al. Three selected stoichiometrics are treated: C60M12, C60M20, and C60M32. The stoichiometrics correspond to the location of the metal atoms above the twelve pentagons, above the twenty hexagons, and above each of the thirty two rings of C60 This interesting arrangement over the rings is possible only for some types of atoms, while other elements are localized above bonds or atoms, or inside the cage, or even react and destroy the cage. Other limitation comes from the parametrization of the computational methods - the computations are performed with the PM3 semiempirical method and metal-layer atomization heats are used as a stability measure. Structural characteristics are presented, too. Considerable reductions of the cage symmetry are reported and their relationships to Jahn-Teller effect are discussed, too (no case of the icosahedral symmetry is found). 相似文献
53.
ZdenĚK Slanina Filip Uhlík Jean-Pierre François Eiji Obarsawa 《Fullerenes, Nanotubes and Carbon Nanostructures》2013,21(4-5):403-415
Abstract Owing to the three-fold degeneracy of the LUMO in C60, its hexa-anion is not subjected to Jahn-Teller distortions. In contrast to the accepted presumptions, however, computations at the MNDO, AMI, PM3, SAM1, HF/STO-3G, HF/3-21G, and HF/4-31G levels show that the completely relaxed, non-icosahedral cage of C6? 60is lower in energy. The computed energy gain varies between 60 and 150 kJ/mol and thus, it is consistently significant (the most sophisticated approach, HF/4-31G, yields 93 kJ/mol). The longest C-C bond in the relaxed structures is at most computed 0.05 Å longer compared to the 5/6 bond in the icosahedral C6? 60The symmetry of C6? 60is relaxed to D2 A C2v, isomer is discussed, too. 相似文献
54.
The Conceptual Design of a Radiant Chamber and Preliminary Optimization of a Process Tubular Furnace
Zdeněk Jegla 《传热工程》2013,34(6):50-57
The design procedure of a process tubular furnace (or fired heater) can generally be divided into three design stages: the preliminary design of furnace, a detailed thermal and hydraulic simulation of the furnace, and final design solution, and the mechanical solution of the furnace (stress analysis, drawings preparation, etc.). The first design stage (the preliminary design of the furnace and cost prediction) is usually connected with a proposal for the customer when only the basic process and furnace design data are usually known. In this design stage, it is appropriate for the furnace designer to not have much detail for a reliable design method. The procedure for the preliminary design of a radiant chamber is usually a main part of such a design method because the radiant chamber represents a basic and dominant part of the modern process tubular furnace. The conceptual (or preliminary) design of the radiant chamber makes up the main part of this process. The presented method is based on standard, time-tested design methods (e.g., the Lobo-Evans method and Belokon's method). It is shown how these standard global design methods can be (for common operating conditions) suitable, generalized, and simplified. It allows for the purpose of the conceptual radiant chamber design the arrangement of the basic heat transfer equation for the radiant chamber. The derived form of the heat transfer equation then allows one to obtain basic process and geometrical radiant chamber characteristics of the given furnace type (cylindrical, box, etc.) iteratively. A developed radiant chamber calculation connected with standard procedures for the design of the furnace convection parts and stack (together with cost predictions) is used, and the method for a quick preliminary evaluation of the influence of the main design and process furnace parameters (dimensions of radiant chamber and convection parts, average heat flux to radiant tubes, absorbed heat in radiant chamber and convection part of furnace, stack size, and fuel consumption) for the total costs was developed. It allows the optimization of the furnace from an investment, operating, or total cost point-of-view in the preliminary design stage of the furnace. The developed method can also be used for the effective solution of the furnace integration into the process. The application of the developed method is demonstrated through a case study—the optimum design of a furnace for a crude atmospheric distillation unit. 相似文献
55.
Vojtech VargaMichal Horá?ek Zdeněk BastlJan Merna Ivana Císa?ováJan Sýkora Ji?í Pinkas 《Catalysis Today》2012,179(1):130-139
The efficient catalytic dehydropolymerization of phenylsilane by homogeneous zirconocene bissilanolates ([{(c-C5H9)7Si8O12O}2Zr(η5-C5H5)2] (1a); [{(c-C5H9)7Si8O12O}2Zr(η5-C5H4Bu)2] (1b) [{(c-C5H9)7Si7O9(OSiMe3)O2}Zr(η5-C5H5)2] (4); [{(Me3CO)3SiO}2Zr(η5-C5H5)2] (5)) and chlorosilanolates ([{(c-C5H9)7Si8O12O}ZrCl(η5-C5H4Bu)2] (2); ([{(c-C5H9)7Si7O9O3}Zr2Cl(η5-C5H5)4] (3a); [{(c-C5H9)7Si7O9O3}Zr2Cl(η5-C5H4Bu)4] (3b)) has been demonstrated. The presence of at least one silanol ligand in the zirconocene moiety was found essential for high catalytic performance. Solid state structure of complex 1a was determined by single crystal X-ray diffraction analysis. A series of nine zirconocene-siliceous catalysts were prepared by grafting of zirconocene moiety onto silica using three general methods: (a) reaction of [(η5-C5H5)2ZrCl2] with silica in the presence of NEt3; (b) reaction of [(η5-C5H5)2ZrMe2] with silica; (c) reaction of solely [(η5-C5H5)2ZrCl2] with silica. Supported catalysts were characterized by ICP-MS, FT-IR, TGA and selected examples by XPS analysis. Those catalysts prepared by method (a) and (b) were found efficient in the phenylsilane polymerization although a higher Zr/monomer ratio had to be used in comparison with homogeneous analogues. The low concentration of residual silanol groups in supported catalysts was found essential for their high catalytic performance. Advantageous reusability of supported catalysts was demonstrated using SiO2(500)/Cp2ZrCl2/NEt3(5.8). The catalytic performance was retained in three consecutive cycles producing polymers with almost identical properties. 相似文献
56.
Compatibilization is the modification of the interface in immiscible polymer blends in order to refine and stabilize their phase structure. The presence of a compatibilizer at the interface markedly affects the deformation behaviour of the dispersed droplets during and after cessation of flow. In this work the morphology development in blends of polystyrene and linear low-density polyethylene compatibilized with styrene-butadiene-styrene triblock copolymer during and after uniaxial elongation was investigated by means of electron microscopy and small-angle X-ray scattering. The incorporation of only 1 wt.-% of the compatibilizer led to a pronounced increase of the stationary elongational viscosity of the blend. It was found, that at moderate capillary number (Ca ≈ CaCR) the compatibilizer stabilises the droplets against break-ups during the flow. When Ca >> CaCR no differences in the deformation of uncompatibilized and compatibilized droplets were observed. After cessation of the flow, the presence of the compatibilizer prevented the droplet break-up and supported and accelerated the shape recovery of the elongated particles. 相似文献
57.
Stanislav Cichoň Petr Machá?Bohumil Barda Zdeněk Sofer 《Microelectronic Engineering》2011,88(5):553-556
This work is dealing with the influence of surface treatment on ohmic contacts to hexagonal N-type SiC with medium doping level. The contact materials were Ni and Ni2Si. The structures had to be annealed at high temperatures in order to reach ohmic behavior. A number of surface treatment methods were tested: wet cleaning, plasma etching, intentional oxidation with etching, H2 annealing and their combinations. After some types of cleaning, the SiC surface was immediately analysed using the XPS method. The results of the analyses showed that the composition of the surface was not much influenced by these treatments. At lower annealing temperatures (approx. up to 850 °C) the prepared contacts showed Schottky behavior with large scatter of parameters. After annealing at approx. 960 °C, where the onset of ohmic behavior is expected, the structures were truly ohmic and of good parameters. Cleaning methods had just a negligible influence on the electrical parameters of the ohmic contacts. An explanation for these observed facts is suggested: Although - already on the basis of the XPS results - we could speak about a negligible influence of the cleaning onto the contact parameters, there might come across also other mechanisms coming from interaction of contact materials with SiC, which caused similar behavior of ohmic contacts on differently treated surfaces. 相似文献
58.
Pavol Koštial Ivan Ružiak Zdeněk Jonšta Ivan Kopal Rudolf Hrehuš Jana Kršková 《International Journal of Thermophysics》2010,31(3):630-636
An experimental system for complex thermo-mechanical material analysis is presented in this article. The system provides simultaneous
measurements of tensile properties as well as heat generation in the process of tensile deformation. The cooling curve of
the sample after its reversible deformation was measured. On the basis of an exponential model of a cooling body with respect
to the Biot number Bi, it is possible to calculate the specific heat capacity c
p
, the thermal diffusivity α, and the thermal conductivity k. The method had been tested on a variety of materials and the results were compared to those in the technical literature
or obtained by reference independent experiments and showed very good agreement. 相似文献
59.
Zden
k P. Ba
ant 《Nuclear Engineering and Design》2001,203(1)
The first part of the paper summarizes various aspects of the prediction of concrete creep and shrinkage to be discussed in the conference lecture. They include the theories of physical mechanism, prediction models, constitutive equations, computational approaches, probabilistic aspects, and research directions. The second part then presents two new prediction models. One of them deals with the approximate prediction formulae for pore relative humidity distributions, required for realistic creep and shrinkage analysis, and the other deals with the extrapolation of short time measurements of creep and shrinkage into long times. 相似文献
60.
Microplane Model M4 for Concrete. II: Algorithm and Calibration 总被引:1,自引:0,他引:1
This paper represents Part II of a two-part study in which a new improved version of the microplane constitutive model for damage-plastic behavior of concrete in 3D is developed. In Part II, an explicit numerical algorithm for model M4 is formulated, the material parameters of model M4 are calibrated by optimum fitting of the basic test data available in the literature, and the model is verified by comparisons with these data. The data in which strain localization must have occurred are delocalized, and the size effect is filtered out from the data where necessary. Although model M4 contains many material parameters, all but four have fixed values for all types of concretes. Thus the user needs to adjust only four free material parameters to the data for a given concrete, for which a simple sequential identification procedure is developed. If the user's data consist only of the standard compression strength and the strain at uniaxial stress peak, the adjustment is explicit and immediate. Good agreement with an unusually broad range of material test data is achieved. 相似文献