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91.
Glen B. Deacon Pauline Pearson Brian W. Skelton Leone Spiccia Allan H. White 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(12):m537-m539
The syntheses and crystal structure determinations of a pair of `sawhorse' dimers are reported, viz. [Ru2(C6H5CO2)2(C5H5N)2(CO)4] [a new polymorph, cf. Kepert, Deacon, Spiccia, Fallon, Skelton & White (2000). J. Chem. Soc. Dalton Trans. pp. 2867–2874] and [Ru2(CF3CO2)2(C5H5N)2(CO)4]. The Ru⋯Ru distances are 2.6724 (2) and 2.7122 (5) Å, respectively. 相似文献
92.
93.
Adam J. Trevitt Fabien Goulay Giovanni Meloni David L. Osborn Craig A. Taatjes Stephen R. Leone 《International journal of mass spectrometry》2009,280(1-3):113
Product detection studies of CN reactions with ethene and propene are conducted at room temperature (4 Torr, 533.3 Pa) using multiplexed time-resolved mass spectrometry with tunable synchrotron photoionization. Photoionization efficiency curves, i.e., the ion signal as a function of photon energy, are used to determine the products and distinguish isomers. Both reactions proceed predominantly via CN addition to the π orbital of the olefin. For CN + ethene, cyanoethene (C2H3CN) is detected as the sole product in agreement with recent studies on this reaction. Multiple products are identified for the CN + propene reaction with 75(±15)% of the detected products in the form of cyanoethene from a CH3 elimination channel and 25(±15)% forming different isomers of C4H5N via H elimination. The C4H5N comprises 57(±15)% 1-cyanopropene, 43(±15)% 2-cyanopropene and <15% 3-cyanopropene. No evidence of direct H abstraction or indirect HCN formation is detected for either reaction. The results have relevance to the molecular weight growth chemistry on Saturn's largest moon Titan, where the formation of small unsaturated nitriles are proposed to be key steps in the early chemical stages of haze formation. 相似文献
94.
Elastic light scattering is reported using monochromatic vacuum-ultraviolet radiation to study free, spherical silica nanoparticles prepared by approaches from colloidal chemistry, with diameters between 100 and 240 nm. The colloidal nanoparticles of defined size are transferred from an aqueous solution into the gas phase using a particle beam experiment. After focusing of the particle beam by an aerodynamic lens, the scattered light from monochromatic synchrotron radiation is measured. Angle-resolved elastically scattered light is detected, showing a strong forward-scattering component. Additional evidence for the detection of elastically scattered light comes from plotting the scattered light intensity as a function of the dimensionless parameter qR, where q is the magnitude of the scattering wave vector and R is the particle radius. This yields different power-law regimes that are assigned to scattering from the surface and the bulk of the nanoparticles. Furthermore, there is evidence for modulations in the scattered light intensity as a function of scattering angle, which is clearly distinguished from the forward-scattering component. The experimental results are compared to Mie scattering simulations for isolated particles, yielding general agreement with the experimental results. Deviations from Mie simulations are observed for samples consisting of significant amounts of aggregates. The present results indicate that the optical properties of free nanoparticles are sensitively probed by vacuum-ultraviolet radiation. 相似文献
95.
The boundary conditions of a vibrating plate are known to have an influence on its sound radiation for frequencies below the critical frequency. To investigate this effect in a systematic way, the average radiation efficiency and radiated power are calculated for a rectangular plate set in an infinite baffle using a modal summation approach. Whereas analytical expressions exist for simply supported boundary conditions, a numerical approach is required for other cases. Nine combinations of boundary conditions are considered, consisting of simply supported, clamped and free edges on different plate edges. The structural vibration is approximated by using independent beam functions in orthogonal directions allowing simple approximate formulae for mode shapes and natural frequencies. This assumption is checked against a finite element model and shown to give reliable results. It is shown that a free plate has the lowest radiation efficiency and a clamped plate the highest for most frequencies between the fundamental panel natural frequency and the critical frequency. Other combinations of boundary condition give intermediate results according to the level of constraint introduced. The differences depend on frequency: excluding the extreme case of a fully free plate all the other boundary conditions give results within a range of 8 dB in the middle part of the short-circuiting region, decreasing towards the critical frequency. At low frequency the differences can be even greater, in some cases up to 20 dB. These conclusions are shown to hold for a range of plate thicknesses and dimensions. 相似文献
96.
A chemoselective, mild, and versatile method for performing postsynthetic modifications of peptide sequences is described. It requires only activated molecular sieves in the presence of an alkyl halide in order to N-alkylate lysine side chains. This reaction is fully compatible with most of the peptide functionalities, discriminates the reactivity of differently protected lysines, and proceeds in good yield. The mild conditions employed were further proved by performing the N-alkylation of a peptide containing a disulfide bridge. 相似文献
97.
Vanja Calija Andrew J. Higgins Phillip A. Jackson Leone M. Bielig Danny Coomans 《Annals of Operations Research》2001,108(1-4):123-142
Selection for superior clones is the most important aspect of sugar cane improvement programs, and is a long and expensive process. While studies have investigated different components of selection independently, there has not been a whole system approach to improve the process. This study observes the problem as an integrated system, where if one parameter changes the state of the whole system changes. A computer based stochastic simulation model that accurately represents the selection was developed. This paper describes the simulation model, showing its accuracy as well as how a combination of dynamic programming and branch and bound can be applied to the model to optimise the selection system, giving a new application of these techniques. The model can be directly applied to any region targeted by sugarcane breeding programs or to other clonally propagated crops. 相似文献
98.
T. Becze-Deák L. Bottyán G. Corradi L. Korecz D. L. Nagy K. Polgár S. Sayed H. Spiering 《Journal of Radioanalytical and Nuclear Chemistry》2000,246(1):33-37
57Co Mössbauer emission spectra of undoped and Fe or Mg melt-doped LiNbO3 single crystals show substantial amounts of the nucleogenic Fe3+ charge state (*Fe3+) which was generated as an after-effect of the electron-capture of 57Co2+. The proportion of *Fe3+ is markedly dependent on the Mg content and on the stoichiometry of the sample. Electron trapping is described within the model of competing acceptors. The capabilities of the model are investigated in defect structure analysis and charge trapping studies of LiNbO3. 相似文献
99.
Luigi Pietro Battaglia Anna Bonamartini Corradi Maria Antonietta Zoroddu 《Journal of chemical crystallography》1990,20(2):161-164
The synthesis, magnetic, and structural properties of the title compound are reported. The crystals are triclinic, space groupP¯1, witha=15.084(2),b=11.820(1),c=7.5253(7) Å, =71.50(1),=77.61(1), =68.68(1)° andZ=1; the structure was solved by Patterson and Fourier methods and refined toR 0.0351 for 4147 observed reflections. The content of the unit cell consists of a centrosymmetrical copper acetate-like molecule in which each copper can be described as square-pyramidally surrounded by four carboxylic oxygens in the basal plane [1.955(2)–1.970(2) Å], one methanolic oxygen in the apical site [2.206(2) Å] and a CuCu interaction of 2.612(5) Å at a sixth position of a distorted octahedron. The dimers are packed by means of hydrogen bonds formed between the methanolic OH group and the carboxylic O(2) atom of one adjacent complex and by normal Van der Waals contacts. The subnormal magnetic moment, characteristic of exchange interactions between the two copper(II) ions, and the energy of the d-d band observed are consistent with the reported dinuclear copper(II) acetate-like structure. 相似文献
100.