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111.
112.
Theoretical expressions and their approximate formulae for the intensities of light diffracted by two adjacent ultrasonic beams are discussed and compared with experimental data for the case when the second beam is an even harmonic of the first (fundamental). In the special case of the fundamental and its second or fourth harmonic, relatively simple formulae are found for the first and second diffraction orders describing the variation of light intensity with phase shift and intensity ratio.The approximate formulae describe the experiments satisfactorily only for small values of ζ1 and αn. For higher values the exact formulae give better agreement. Only the Raman-Nath region is considered. 相似文献
113.
A theoretical study of substituent effects on 1,3-dipolar cycloadditions has been carried out by the LCAO-SCF-MO method. The potential energy hypersurfaces for ten reactions and the electronic and energetic properties of the transition states have been investigated. 相似文献
114.
115.
116.
The extraction of Co(II) with mixtures of 1-phenyl-3-methyl-4-benzoyl-pyrazol-5-one ((H)PMBP) and tri-n-octylamine (TOA) is investigated in order to explore the influence of diluents and inorganic anions with synergistic acidic extractant + liquid anion exchanger systems. Although it is proved that the same species [HTOA]+ [Co(PMBP)3]? is extracted from various inorganic media, with toluene as the diluent, the presence of ClO4? SO42? or Cl? anion modifies the distribution of the anions which are associated to (HTOA)+ in the organic phase, leading to different synergistic equilibria; with Cl? or SO42?: + ,PMBP?) ?,Co(PMBP)3? (log K = 6.10) and with ClO4? : + + ,ClO4? ? ,Co(PMBP)3? + H+ + ClO4? (log K = 2.34) The same synergistic equilibrium is observed for the extraction of Ni(II) from ClO4? medium, with a comparable value of the constant (log K = 2.45). The synergistic effect is cancelled in n-octanol. 相似文献
117.
J.-M. Andr M. Cl. Andr G. Leroy J. Weiler 《International journal of quantum chemistry》1969,3(6):1013-1025
All-electron SCF –LCAO –MO computations for diazomethane, ketene and allene are presented. The basis functions are contracted Gaussian orbitals. Theoretical results are discussed and related to available experimental data. 相似文献
118.
W.D. Apel K.H. Augenstein E. Bertolucci S.V. Donskov A.V. Inyakin V.A. Kachanov R.N. Krasnokutsky M. Kruger G. Leder A.A. Lednev I. Mannelli Yu.V. Mikhailov H. Müller G.M. Pierazzini Yu.D. Prokoshkin M. Quaglia H. Schneider A. Scribano M.L. Vincelli 《Physics letters. [Part B]》1978,72(4):500-502
The invariant mass spectrum of neutral final states produced in π?p charge-exchange scattering at 40 GeV/c has been studied, searching for heavy particles decaying in 2γ. A peak is observed around 2.85 GeV/c2. The cross section of the reaction π?p→X(2.85)+n, times the branching ratio of the X→2γ decay, is measured to be . 相似文献
119.
We present a theoretical study of the propagation of a monochromatic pressure wave in an unbounded monodisperse bubbly liquid.
We begin with the case of a regular bubble array --a bubble crystal-- for which we derive a dispersion relation. In order
to interpret the different branches of this relation, we introduce a formalism, the radiative picture, which is the adaptation
to acoustics of the standard splitting of the electric field in an electrostatic and a radiative part in Coulomb gauge. In
the case of an irregular or completely random array --a bubble glass-- and at wavelengths large compared to the size of the
bubble array spatial inhomogeneities, the difference between order and disorder is not felt by the pressure wave: a dispersion
relation still holds, coinciding with that of a bubble crystal with the same bubble size and air volume fraction at the centre
of its first Brillouin zone. This relation is discussed and compared to that obtained by Foldy in the framework of his multiscattering
approach. 相似文献
120.
Dedryvère R Leroy S Martinez H Blanchard F Lemordant D Gonbeau D 《The journal of physical chemistry. B》2006,110(26):12986-12992
X-ray photoelectron valence spectra of lithium salts LiBF4, LiPF6, LiTFSI, and LiBETI have been recorded and analyzed by means of density functional theory (DFT) calculations, with good agreement between experimental and calculated spectra. The results of this study are used to characterize electrode/electrolyte interfaces of graphite negative electrodes in Li-ion batteries using organic carbonate electrolytes containing LiTFSI or LiBETI salts. By a combined X-ray photoelectron spectroscopy (XPS) core peaks/valence analysis, we identify the main constituents of the interface. Differences in the surface layers' composition can be evidenced, depending on whether LiTFSI or LiBETI is used as the lithium salt. 相似文献