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131.
Rudolf Gensler Peter Grppel Volker Muhrer Norbert Müller 《Particle & Particle Systems Characterization》2002,19(5):293-299
Different organophilic layered silicates and a modified hydrotalcite were used as functional nanofillers for thermoplastic and thermosetting polymers. Polyamide 6 (PA6) and poly(butylene terephthalate) silicate nanocomposites were prepared by melt compounding using a twin‐screw extruder. The morphology of the materials was investigated by transmission electron microscopy and small‐angle X‐ray scattering, and was found to be characterized by homogeneous dispersion of high aspect ratio silicate layers in the polymer matrix. The PA6 nanocomposite displayed excellent thermo‐mechanical properties at low filler loadings and improved barrier properties. Epoxy nanocomposites have also been prepared and characterized with regard to their morphology and their water vapor permeability. 相似文献
132.
Norbert Engel Albert Gossauer Karl Gruber Christoph Kratky 《Helvetica chimica acta》1993,76(6):2236-2238
The molecular structure of a chlorophyll a catabolite isolated from the culture medium of bleached Chlorella protothecoides cells has been determined by X-ray diffraction; the crystal structure shows a distorted helical arrangement of the pyrrole rings and consists of symmetrical dimers located at a crystallographic diad, which are stabilized by six intermolecular H-bonds. 相似文献
133.
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135.
Kucerka N Papp-Szabo E Nieh MP Harroun TA Schooling SR Pencer J Nicholson EA Beveridge TJ Katsaras J 《The journal of physical chemistry. B》2008,112(27):8057-8062
The asymmetric outer membrane of Gram-negative bacteria contains lipopolysaccharides (LPSs) which contribute significantly to the bacterium's surface properties and play a crucial role in regulating membrane permeability. We report on neutron diffraction studies performed on aligned, self-assembled bilayers of Na-, Ca-, and Mg-salt forms of LPS isolated from Pseudomonas aeruginosa PAO1. From the one-dimensional neutron scattering length density profiles we find that water penetrates Ca2+-LPS bilayers to a lesser extent than either Na+- or Mg2+-LPS bilayers. This differential water penetration could have implications as to how small molecules permeate the outer membrane of Gram-negative bacteria and, possibly, how nonlamellar phases are formed. 相似文献
136.
Jens Rudlof Niklas Aders Dr. Jan-Hendrik Lamm Beate Neumann Dr. Hans-Georg Stammler Prof. Dr. Norbert W. Mitzel 《ChemistryOpen》2021,10(10):1020-1027
Starting from 1,2-diethynylbenzene, a series of bidentate Lewis acids was prepared by means of hydrometalations, in particular hydrosilylation, hydroboration, hydroalumination and terminal metalation based on group 13 and 14 elements. In the case of terminal alkyne metalation, the Lewis-acidic gallium function was introduced using triethylgallium under alkane elimination. A total of six different Lewis acids based on a semiflexible organic scaffold were prepared, bearing −SiClMe2, −SiCl2Me, −SiCl3, −B(C6F5)2, −AlBis2 (Bis=bis(trimethylsilyl)methyl) and −GaEt2 as the corresponding functional units. In all cases, the Lewis acid functionalisation was carried out twice and the products were obtained in good to excellent yields. In the case of the twofold gallium Lewis acid, a different structural motif in the form of a polymer-like chain was observed in the solid state. All new bidentate Lewis acids were characterised by multinuclear NMR spectroscopy, CHN analysis and X-ray diffraction experiments. 相似文献
137.
Xiaoqing Zeng Helmut Beckers Helge Willner Raphael J. F. Berger Stuart A. Hayes Norbert W. Mitzel 《ChemInform》2011,42(19):no-no
The title compound is characterized by IR (gas phase, Ar matrix), Raman (liquid, amorphous, and crystalline solid), and 19F, 31P, 14N and 15N NMR spectroscopy, as well as by quantum chemical DFT calculations. 相似文献
138.
Heike Fliegl Olli Lehtonen Ying-Chan Lin Michael Patzschke Dage Sundholm 《Theoretical chemistry accounts》2011,129(3-5):701-713
The molecular structures of cyclic group 6 transition-metal (M = Cr, Mo, W, Sg) oxides (M 3O 9 0/1?/2? ) species have been optimized at density functional theory (DFT) levels. The photoelectron spectra (PES) of M 3O 9 ? (M = Cr, Mo, W) were calculated at the time-dependent DFT and approximate coupled-cluster singles doubles (CC2) levels and compared with experimental results. The CC2 calculations did not yield any reliable PES, whereas the molecular structures can be identified by comparing PES obtained at the DFT level with experiment. Magnetically induced current densities were calculated at the DFT level using the gauge-including magnetically induced current (gimic) approach. The current strengths and current pathways of the neutral M3O9 and the dianionic M3O 9 2? (M = Cr, Mo) oxides were investigated and analyzed with respect to a previous prediction of d-orbital aromaticity for Mo3O9 anions. Current-density calculations provide ring-current strengths that are used to assess the degree of aromaticity. Comparison of current-density calculations and calculations of nucleus-independent chemical shifts (NICS) shows that NICS calculations are not a reliable tool for determining the degree of aromaticity of the metal oxides. 相似文献
139.
Jieping Wang Norbert Moszner Kurt Dietliker Hansjörg Grützmacher Robert Liska 《Journal of polymer science. Part A, Polymer chemistry》2016,54(4):473-479
The monoacylphosphineoxide (MAPO) salts Na‐TPO and Li‐TPO and the bisacylphosphineoxide (BAPO) salts BAPO‐ONa and BAPO‐OLi define an important and in the latter case a new class of water‐soluble photoinitiators (PIs) for radical polymerization. These compounds showed excellent water‐solubility of at least 29 g/L for Na‐TPO and up to 60 g/L for BAPO‐ONa in deionized water, thus exceeding the solubility of the state of the art PI for water‐based systems Irgacure 2959 ( I2959 ) 6‐ to 12‐fold. However, biocompatibility, storage stability, and reactivity were equally important to replace the state of the art compounds. Concerning these properties, the MAPO and BAPO salts were at least in the same range (biocompatibility, stability) or showed even better results (reactivity) and had the additional advantage of visible light initiation. Na‐TPO and Li‐TPO achieved double bond conversions of an aqueous solution of N‐acryloylmorpholine over 97% with broad band irradiation (320–500 nm), Li‐TPO showed additionally very good biocompatibility (LC50 = 3.1 mmol/L) and BAPO‐OLi showed highest reactivity with visible light irradiation. © 2015 Wiley Periodicals, Inc. J. Polym. Sci., Part A: Polym. Chem. 2016 , 54, 473–479 相似文献
140.
Dr. Yuexia Wang Dr. Giovanni Barcaro Dr. Fabio R. Negreiros Dr. Thierry Visart de Bocarmé Dr. Mathieu Moors Dr. Norbert Kruse Dr. Marc Hou Dr. Alessandro Fortunelli 《Chemistry (Weinheim an der Bergstrasse, Germany)》2013,19(1):406-413
Carbon adsorption on various Ni surfaces is investigated as a function of coverage via a combination of first‐principles simulations and field emission microscope experiments. It is found that carbon can be efficiently stored as subsurface carbides, but with different energetics on differently oriented surfaces depending on their compactness and density of adsorption sites. In the resulting morphological reshaping, {113} facets are predicted to grow at the expense of {111} and {100} facets, in excellent agreement with experimental observations. Moreover, at high coverage on the {113} surface the carbon adsorption energy passes through a maximum after which a structural crossover is realized such that carbon atoms tend to ascend to the surface to form one‐dimensional chains (which are the precursors of graphitic nanostructures). This rationalizes the experimental observation of an incubation time between carbon storage and the beginning of catalytic growth, and provides insight into the early stages (nucleation mechanism) of carbon nanotubes on Ni nanoparticles. 相似文献