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1.
2.
We have studied the characteristic features of carbazole phosphorescence quenching by benzophenone in toluene at 77 K. We
have shown that the decrease in the relative phosphorescence intensity for carbazole (energy donor) by a greater factor than
we see for the relative change in its decay time is due to the fact that a change in the phosphorescence decay time occurs
only for carbazole molecules participating in triplet-triplet energy transfer, while the substantial decrease in the phosphorescence
intensity for carbazole with no change in the phosphorescence decay time is connected with quenching of its singlet states.
__________
Translated from Zhurnal Prikladnoi Spektroskopii, Vol. 73, No. 4, pp. 554–556, July–August, 2006. 相似文献
3.
Georgi R. Grozev 《Numerische Mathematik》1989,56(4):331-343
Summary LetLM
N be the set of allL-monosplines withN free knots, prescribed by a pair (x;E) of pointsx = {x
i
}
1
n
,a <x
1 < ... <x
n
<b and an incidence matrixE = (e
ij
)
i=1
n
,
r-1
j=0
with
Denote byLM
N
O
the subset ofLM
N consisting of theL-monosplines withN simple knots (n=N). We prove that theL-monosplines of minimalL
p-norms inLM
N belong toLM
N
O
.The results are reformulated as comparison theorems for quadrature formulae. 相似文献
4.
Georgi E. Chernev Bisserka I. Samuneva Petar R. Djambaski Isabel M. M. Salvado Helena V. Fernandes 《Central European Journal of Chemistry》2006,4(1):81-91
In this work we present experimental results about the formation, properties and structure of sol — gel silica based biocomposite
containing Calcium alginate as an organic compound. Two different types of silicon precursors have been used in the synthesis:
tetramethylortosilicate (TMOS) and ethyltrimethoxysilane (ETMS). The samples have been prepared at room temperature. The hybrids
have been synthesized by replacing different quantitis of the inorganic precursor with alginate. The structure of the obtained
hybrid materials has been studied by XRD, IR Spectroscopy, EDS, BET and AFM. The results proved that all samples are amorphous
possessing a surface area from 70 to 290 m2/g. It has also been established by FT IR spectra that the hybrids containing TMOS display Van der Walls and Hydrogen bonding
or electrostatic interactions between the organic and inorganic components. Strong chemical bonds between the inorganic and
organic components in the samples with ETMS are present. A self-organized nanostructure has been observed by AFM. In the obtained
hybrids the nanobuilding blocks average in size at about 8–14 nm for the particles. 相似文献
5.
6.
Krause M Popov VN Inakuma M Tagmatarchis N Shinohara H Georgi P Dunsch L Kuzmany H 《The Journal of chemical physics》2004,120(4):1873-1880
Metal-carbon cage vibrations of crystalline endohedral D2d-M2@C84 (M=Sc,Y,Dy) dimetallofullerenes were analyzed by temperature dependent Raman scattering and a dynamical force field model. Three groups of metal-carbon cage modes were found at energies of 35-200 cm(-1) and assigned to metal-cage stretching and deformation vibrations. They exhibit a textbook example for the splitting of molecular vibrations in a crystal field. Induced dipole-dipole and quadrupole-quadrupole interactions account quantitatively for the observed mode splitting. Based on the metal-cage vibrational structure it is demonstrated that D2d-Y2@C84 dimetallofullerene retains a monoclinic crystal structure up to 550 K and undergoes a transition from a disordered to an ordered orientational state at a temperature of approximately 150 K. 相似文献
7.
The mechanism of the keto-enol tautomerism of malonaldehyde was studied by ab initio methods using 6-21G** and 6-311G** basis functions at the HF level. Two separate mechanisms were examined: through-space proton transfer in the ω-shaped form and through-space proton transfer in a sickle-shaped form obtained from the ω form by rotation. The transition state structure of the ω form is non-planar, whereas that of the sickle form is planar. The sickle form is connected with a 2nd order saddle, indicating that there should exist a lower energy barrier, i.e. that the through-bond mechanism may be preferred. The calculated energy barriers of keto-enol tautomerism for the sickle form is twice as high as those for the omega form. 相似文献
8.
In conclusion, let us note the principal results of the calculation.
Institute of Catalysis, Siberian Branch, Russian Academy of Sciences. Translated from Zhurnal Strukturnoi Khimii, Vol. 33, No. 2, pp. 35–41, March-April, 1992. 相似文献
1. | On a clean Ni(100) surface, only molecular adsorption of water is realized. Partial dissociation of H2O is thermodynamically allowed process; however, dissociation of water is impossible because of kinetic limitations. |
2. | Modification of the nickel surface by oxygen stabilizes the donor-acceptor pair (H2O/O) on the surface and removes the kinetic limitation in decomposition of water, through a substantial reduction of the activation energy of dissociation. |
3. | The promoting role of oxygen is manifested in an increase in the nonuniformity of electron density on the nickel surface in the vicinity of the [Ni]–OH2 bond, which makes it possible to open up a new channel of the reaction in which a high degree of energy compensation in the water dissociation reaction is possible. |
9.
10.