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71.
The intergrowth of 1,10-decanedicarboxylic acid and urea give infinite hydrogen-bonded chains of the guest included in the hexagonal urea host. A deuterium high-resolution solid-state NMR study of the selectively deuterated intergrowth compound 1,10-decanedicarboxylic acid/hydrogenated urea at variable temperature in the range 90 < or = T < or = 300 K was performed on a single crystal. The analysis of the second moment as a function of temperature is shown to be compatible with the known phase transition occurring near T(c) = 203 K. Moreover, the spectra indicate that the orientational disorder is strong, and is compared to an axial uniform disorder. For this purpose, the general equation for the second moment of a system with uniform two-dimensional axial orientational disorder is given, and a method to take into account the non-uniform excitation of the pulse sequence is proposed. 相似文献
72.
M. E. Garcia G. M. Pastor K. H. Bennemann 《Zeitschrift für Physik D Atoms, Molecules and Clusters》1993,26(1):293-295
The electronic properties of neutral and ionized divalent-metal clusters have been studied using a microscopic theory, which takes into account the interplay between van der Waals (vdW) and covalent bonding in the neutral clusters, and the competition between hole delocalization and polarization energy in the ionized clusters. By calculating the ground-state energies of neutral and ionized Hg n clusters, we determine the size dependence of the bond character and the ionization potentialI p (n). For neutral Hg n clusters we obtain a transition from van der Waals to covalent behaviour at the critical sizen c ~10–20 atoms. Results forI p (Hg n ) withn≤20 are in good agreement with experiments, and suggest that small Hg n + clusters can be viewed as consisting of a positive trimer core Hg 3 + surrounded byn?3 polarized neutral atoms. 相似文献
73.
The reaction of several α-amino acids and peptides (containing Gly, L-Ala, L-Leu, L- or DL-Phe, and/or L- or D-Val) with air-diluted nitrogen oxides has been studied to roughly mimic the N-nitrosation of peptide bonds that the contaminated urban air might produce in pulmonary tissues. Most N-protected α-amino acids give practically quantitative yields of N-nitroso derivatives. N-Protected dipeptides afford either dinitrosated peptides, mixtures of di- and mononitrosated compounds, selectively mononitrosated products, or no reaction at all, depending mainly on steric effects. The same trends are observed for some higher peptides. The (po1y)nitrosated Peptides, which retain the chirality of the starting materials, have been characterized by 1H and 13C NMR spectroscopy and are cleaved by pyrrolidine and amino esters under mild conditions to give (new) amides or peptides plus diazo derivatives. 相似文献
74.
Magno Aparecido G. Trindade Glaucia Maria da Silva Valdir Souza Ferreira 《Microchemical Journal》2005,81(2):209-216
This work presents an electroanalytical methodology developed for square-wave voltammetry based in the electrochemical reduction in hanging mercury drop electrode (HMDE), which is simple, fast, reliable and sensitive for determination of moxifloxacin (MOXI) in tablets and spiked urine human samples. The support electrolyte that provided a more defined and intense peak current for MOXI determination was the phosphate buffer 0.04 mol l− 1 pH 8.0. In the best-optimized conditions the drug presented an only peak of reduction at − 1.38 V vs. Ag/AgCl, using an Eacc. of − 0.30 V. An LOD of 0.44 and 3.20 ng ml− 1 and an LOQ of 1.46 and 10.60 ng ml− 1 were found for the pure standard of moxifloxacin and in the presence of matrix, respectively. A good recovery was obtained for assay spiked urine samples and a good quantification of MOXI was achieved in a commercial formulation. The methodology proposed was more sensitive than the spectrofluorimetric and spectrophotometric method with precision and accuracy equivalent. 相似文献
75.
The effects of anionic, non-ionic, and cationic surfactants and thallium(I) nitrate on the paper-substrate room-temperature phosphorescence (RTP) of eleven phenothiazine derivatives are described. Enhancement factors within the range 1.5–10 are observed after addition of sodium dodecylsulfate, dodecyltrimethylammonium chloride and thallium(I) nitrate. The influence of surfactant on phosphor characteristics as well as effects of moisture are discussed. Limits of detection were in the range 0.2–2 ng. Results are also reported for p-aminobenzoic acid, carbazole and o-terphenyl. 相似文献
76.
Ferreira O. P. Lemes M. Prudente L. F. 《Computational Optimization and Applications》2022,81(1):91-125
Computational Optimization and Applications - The purpose of this paper is to present an inexact version of the scaled gradient projection method on a convex set, which is inexact in two sense.... 相似文献
77.
Silva Julio Cezar Soares de Lima Silva Diogo Ferreira Ferreira Luciano de Almeida-Filho Adiel Teixeira 《4OR: A Quarterly Journal of Operations Research》2022,20(1):139-164
4OR - Even though sovereign bonds represent low-risk alternatives that give investors a healthy income, the risk assessment process for these bonds is still considered subjective because of the... 相似文献
78.
Sérgio L. C. Ferreira Neyla M. L. Araújo Adriana B. Santos Alailson F. Dantas A. C. Spinola Costa 《Mikrochimica acta》1995,118(1-2):123-129
TAN reacts with zinc(II) forming a red complex with composition 1:2 Zn(II)-TAN and absorption maximum at 582 nm. Zinc can be determined with this reagent in the presence of Triton X-100, in the pH range 6.20-8.00 with a molar absorptivity of 4.5×104 l/mol/cm Beer's Law was obeyed up to least 1.55 g/ml. Copper interference was eliminated with a mixture of thiosulfate and ascorbic acid and nickel separated by precipitation with dimethylglyoxime. The proposed method was used for zinc determination in several copper-base alloys and the results of analysis in comparison with certified values indicated that the procedure was accurate and precise. A derivative procedure is also proposed, allowing zinc determination with high sensitivity (5-400 ng/ml). 相似文献
79.
80.