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71.
Friis Helmer André Pedersen Janne Jettestuen Espen Helland Johan Olav Prodanović Maša 《Transport in Porous Media》2019,128(1):123-151
Transport in Porous Media - Multiphase flow simulations on imaged porous rock structures require numerical methods that are accurate and robust when applied on complex geometries. A key element in... 相似文献
72.
Wei Duo Orlandi Ezequiel Barriet Mathilde Simon Sébastien Sjöblom Johan 《Journal of Thermal Analysis and Calorimetry》2015,121(1):463-468
Journal of Thermal Analysis and Calorimetry - This paper describes the self-association of tetrameric acids (TA) and their interactions with asphaltenes using isothermal titration calorimetry. In... 相似文献
73.
Dr. Jagadeesh Yerri Dr. José Dias Dr. Mallikajurna Reddy Nimmakayala Franck Razafindrainibe Charlotte Courageux Anne-Julie Gastellier Johanne Jegoux Dr. Caroline Coisne Dr. Christophe Landry Dr. Fabien Gosselet Johan Hachani Dr. Jean-François Goossens Prof. Marie-Pierre Dehouck Dr. Florian Nachon Dr. Rachid Baati 《Chemistry (Weinheim an der Bergstrasse, Germany)》2020,26(65):15035-15044
Novel 6-alkyl- and 6-alkenyl-3-fluoro-2-pyridinaldoximes have been synthesised by using a mild and efficient chemoselective hydrogenation of 6-alkynyl-3-fluoro-2-pyridinaldoxime scaffolds, without altering the reducible, unprotected, sensitive oxime functionality and the C−F bond. These novel 6-alkyl-3-fluoro-2-pyridinaldoximes may find medicinal application as antidotes to organophosphate poisoning. Indeed, one low-molecular-weight compound exhibited increased affinity for sarin-inhibited acetylcholinesterase (hAChE) and greater reactivation efficiency or resurrection for sarin-inhibited hAChE, compared with those of 2-pyridinaldoxime (2-PAM) and 1-({[4-(aminocarbonyl)pyridinio]methoxy}methyl)-2-[(hydroxyimino)methyl]pyridinium chloride (HI-6), two pyridinium salts currently used as antidote by several countries. In addition, the uncharged 3-fluorinated bifunctional hybrid showed increased in vitro blood–brain barrier permeability compared with those of 2-PAM, HI-6 and obidoxime. These promising features of novel low-molecular-weight alkylfluoropyridinaldoxime open up a new era for the design, synthesis and discovery of central non-quaternary broad spectrum reactivators for organophosphate-inhibited cholinesterases. 相似文献
74.
Dr. Nan Wang Dr. Shuping Wang Prof. Luping Tang Dr. Lilei Ye Björn Cullbrand Abdelhafid Zehri Dr. Behabitu Ergette Tebikachew Prof. Johan Liu 《Chemistry (Weinheim an der Bergstrasse, Germany)》2020,26(29):6561-6568
Poor bonding strength between nanomaterials and cement composites inevitably lead to the failure of reinforcement. Herein, a novel functionalization method for the fabrication of functionalized graphene oxide (FGO), which is capable of forming highly reliable covalent bonds with cement hydration products, and therefore, suitable for use as an efficient reinforcing agent for cement composites, is discussed. The bonding strength between cement and aggregates was improved more than 21 times with the reinforcement of FGO. The fabricated FGO also demonstrated many important features, including high reliability in cement pastes, good dispersibility, and efficient structural refinement of cement hydration products. With the incorporation of FGO, cement mortar samples demonstrated up to 40 % increased early and ultimate strength. Such results make the fast demolding and manufacture of light constructions become highly possible, and show strong advantages on improving productivity, saving cost, and reducing CO2 emissions in practical applications. 相似文献
75.
Optimization of neural network for ionic conductivity of nanocomposite solid polymer electrolyte system (PEO-LiPF6-EC-CNT) 总被引:1,自引:0,他引:1
Mohd Rafie Johan Suriani Ibrahim 《Communications in Nonlinear Science & Numerical Simulation》2012,17(1):329-340
In this study, the ionic conductivity of a nanocomposite polymer electrolyte system (PEO-LiPF6-EC-CNT), which has been produced using solution cast technique, is obtained using artificial neural networks approach. Several results have been recorded from experiments in preparation for the training and testing of the network. In the experiments, polyethylene oxide (PEO), lithium hexafluorophosphate (LiPF6), ethylene carbonate (EC) and carbon nanotubes (CNT) are mixed at various ratios to obtain the highest ionic conductivity. The effects of chemical composition and temperature on the ionic conductivity of the polymer electrolyte system are investigated. Electrical tests reveal that the ionic conductivity of the polymer electrolyte system varies with different chemical compositions and temperatures. In neural networks training, different chemical compositions and temperatures are used as inputs and the ionic conductivities of the resultant polymer electrolytes are used as outputs. The experimental data is used to check the system’s accuracy following the training process. The neural network is found to be successful for the prediction of ionic conductivity of nanocomposite polymer electrolyte system. 相似文献
76.
Estefanía Moreno-Gordaliza Sven J. van der Lee Ayşe Demirkan Cornelia M. van Duijn Johan Kuiper Petrus W. Lindenburg Thomas Hankemeier 《Analytica chimica acta》2016
A new capillary isotachophoresis (cITP) method for lipoprotein profiling with superior lipoprotein coverage compared to previous methods has been developed, resolving twice as many lipoprotein species (18 peaks/fractions) in serum or plasma in less than 9.5 min. For this, a novel mixture of 24 spacers, including amino acids, dipeptides and sulfonic acids, was developed and fine-tuned, using predictive software (PeakMaster) and testing of spiked serum samples. Lipoprotein peaks were identified by serum-spiking with reference lipoproteins. Compatibility with common lipophilic stains for selective lipoprotein detection with either UV/Vis or laser-induced fluorescence was demonstrated. A special new capillary with a neutral coating (combining water-compatible OV1701-OH deactivation and methylation) was used for the first time for electrodriven separations, allowing very stable separations in a pH 8.8–9.4 gradient system, being functional for more than 100 injections. Excellent reproducibility was achieved, with coefficients of variation lower than 2.6% for absolute migration times. Comparison was performed with human plasma samples analyzed by NMR, leading to similar results with cITP after multivariate statistics, regarding group-clustering and lipoprotein species correlation. The new cITP method was applied to the analysis of serum samples from a LDL receptor knock-out mice model fed either a normal diet or a western-type diet. Differences in the lipoprotein levels and in the sublipoprotein types were detected, showing a shift to more atherogenic particles due to the high cholesterol diet. In summary, this novel method will allow more detailed and informative profiling of lipoprotein particle subtypes for cardiovascular disease research. 相似文献
77.
The p-median model is used to locate P centers to serve a geographically distributed population. A cornerstone of such a model is the measure of distance between a service center and demand points, i.e. the location of the population (customers, pupils, patients, and so on). Evidence supports the current practice of using Euclidean distance. However, we find that the location of multiple hospitals in a rural region of Sweden with a non-symmetrically distributed population is quite sensitive to distance measure, and somewhat sensitive to spatial aggregation of demand points. 相似文献
78.
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80.
Vladimir Petukhov John Stoemenos Johan Rothman Andrey Bakin Andreas Waag 《Applied Physics A: Materials Science & Processing》2011,102(1):161-168
In order to interpret results of temperature dependent Hall measurements in heteroepitaxial ZnO-thin films, we adopted a multilayer
conductivity model considering carrier-transport through the interfacial layer with degenerate electron gas as well as the
upper part of ZnO layers with lower conductivity. This model was applied to the temperature dependence of the carrier concentration
and mobility measured by Hall effect in a ZnO-layer grown on c-sapphire with conventional high-temperature MgO and low-temperature
ZnO buffer. We also compared our results with the results of maximum entropy mobility-spectrum analysis (MEMSA). The formation
of the highly conductive interfacial layer was explained by analysis of transmission electron microscopy (TEM) images taken
from similar layers. 相似文献