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461.
The behavior of symmetric diblock copolymer chains of two different lengths at different concentrations is simulated by means of the bond fluctuation model. Two alternative sets of energies between interacting neighbors are proposed. In one of the sets, attractions between monomers of the same type are considered. In the other set, repulsions between monomers of different types are considered. The collective scattering of the simulation boxes is computed for different values of the reduced energy interaction parameter and the total polymer volume fraction. The analysis of this property is used to locate the transition associated with the formation of mesophases (lamellae) as a function of these two variables. A comparison between the results corresponding to the two different models is performed. When the significant excluded volume corrections are introduced in the model with repulsive interactions, both sets of data agree, except for the most dilute samples. The agreement with the self‐consistent field theory is only fair, and important differences are observed in the intermediate concentration regime. These differences were expected, since the theoretical treatment is only rigorously valid for very long chains.
462.
Palma Marcia B. Pinto Annette L. Gombert Andreas K. Seitz Karina H. Kivatinitz Silvia C. Castilho Leda R. Freire Denise M. G. 《Applied biochemistry and biotechnology》2000,84(1-9):1137-1145
Lipase, protease, and amylase production by Penicillium restrictum in solid-state fermentation was investigated. The basal medium was an industrial waste of babassu oil (Orbignya oleifera) production. It was enriched with peptone, oliveoil, and Tween-80. The supplementation positively influenced both enzyme
production and fungal growth. Media enriched with Tween-80 provided the highest protease activity (8.6 U/g), whereas those
enriched with peptone and olive oil led to the highest lipase (27.8 U/g) and amylase (31.8 U/g) activities, respectively. 相似文献
463.
Eleonora Freire Sergio Baggio Ricardo Baggio Raúl Mariezcurrena 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(8):926-929
The title compounds, [Ni(S2O3)(C12H8N2)2]·0.92H2O·1.4CH4O and [Ni(S2O3)(C10H8N2)2]·2H2O·0.55CH4O, are monomeric, containing nickel(II) in a distorted octahedral coordination environment provided by the four N atoms of two bidentate bipy or phen groups and one S and one O atom from a chelating thiosulfate anion. The crystals are highly unstable outside their mother liquors and are stabilized in solution by a not fully determined number of water and methanol solvate molecules. The phenanthroline structure includes two independent moieties related by a non‐crystallographic inversion center. The thiosulfate anions display the usual S—O lengthening found when the anion acts in a bidentate mode. 相似文献
464.
In this paper we develop numerical algorithms for thecontinuation of degenerate homoclinic orbits to non-hyperbolicequilibria in planar systems. The first situation corresponds to asaddle-node equilibrium (a zero eigenvalue) and the second one is theso-called cuspidal loop (double-zero eigenvalue). The methods proposedmay deal with codimension-two and -three homoclinic connections.Application of the algorithms to several examples supports its validityand demonstrates its usefulness. 相似文献
465.
R. J. C. Lima A. J. D. Moreno E. M. Diniz R. S. G. Ola J. M. Sasaki J. Mendes Filho P. T. C. Freire F. M. Pontes E. R. Leite E. Longo 《Crystal Research and Technology》2004,39(10):864-867
Leaves and branches of Ocimum Basilicum were dried, reduced to coarse powder and extracted in aqueous metanol and aqueous hexane. This paper discusses the X‐ray diffraction and FT‐Raman spectra measured at room temperature. The data obtained have been used to propose a general assignment of the vibrational fundamentals on the base of frequencies assigned in other related single crystals. From the results we can conclude that the crystal has a high symmetry. (© 2004 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim) 相似文献
466.
Mössbauer spectroscopic studies of [Fe(di(amH)-sar)](NO3)4·H2O where di(amH)-sar represents 1,8 diamino 3,6,10,13,16,19-hexaza bicyclo [6,6,6] icosane in the temperature range of 4.2 to 300 K suggest that it undergoes a dynamic Jahn-Teller effect as revealed from the plots of temperature dependent quadrupole coupling constant, chemical shift and line width values. The spectrum down to 4.2 K, shows a quadrupole doublet with no magnetic hyperfine splitting. 相似文献
467.
María Lago-Silva María Magdalena Cid Prof. Emilio Quiñoá Prof. Félix Freire 《Angewandte Chemie (International ed. in English)》2023,62(29):e202303329
Helix inversion in chiral dynamic helical polymers is usually achieved by conformational changes at the pendant groups induced through external stimuli. Herein, a different mechanism of helix inversion in poly(phenylacetylene)s (PPAs) is presented, based on the activation/deactivation of supramolecular interactions. We prepared poly[(allenylethynylenephenylene)acetylene]s (PAEPAs) in which the pendant groups are conformationally locked chiral allenes. Therefore, their substituents are placed in specific spatial orientations. As a result, the screw sense of a PAEPA is fixed by the allenyl substituent with the optimal size/distance relationship to the backbone. This helical sense command can be surpassed by supramolecular interactions between another substituent on the allene and appropriate external stimuli, such as amines. So, a helix inversion occurs through a novel axial-to-helical communication mechanism, opening a new scenario for taming the helices of chiral dynamic helical polymers. 相似文献
468.
469.
Juan J. Freire Luis A. Molina Antonio Rey Keiichiro Adachi 《Macromolecular theory and simulations》1999,8(4):321-327
A dynamic Monte Carlo algorithm is employed to investigate the dynamics of flexible linear and star chains on a cubic lattice at different concentrations. Some results for similar systems are also obtained with an off‐lattice algorithm. Diffusion coefficient, relaxation times and mean size data are combined into friction‐independent ratios in good agreement with the theoretical predictions from the Rouse theory. The relaxation times and amplitudes corresponding to the Rouse normal modes are analyzed in terms of their variation with the mode order. The end‐to‐end vector correlation times obtained from the simulations for linear chains are compared with the theoretical expression obtained from the Rouse theory. Deviations from this theory are observed for the contribution of the different modes in the non‐dilute systems. Finally, the time correlation function corresponding to a subchain's end‐to‐end vector is investigated. The results also show deviations from the Rouse theory, which are in qualitative agreement with the features observed in data from dielectric relaxation experiments of block copolymers. 相似文献
470.