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61.
Recently, the Heisenberg's uncertainty principle has been extended to incorporate the existence of a large (cut-off) length scale in de Sitter or anti-de Sitter space, and the Hawking temperatures of the Schwarzshild–(anti) de Sitter black holes have been reproduced by using the extended uncertainty principle. I generalize the extended uncertainty to the case with an absolute minimum length and compute its modification to the Hawking temperature. I obtain a general trend that the generalized uncertainty principle due to the absolute minimum length “always” increases the Hawking temperature, implying “faster” decay, which is in conformity with the result in the asymptotically flat space. I also revisit the black hole-string phase transition, in the context of the generalized uncertainty principle.  相似文献   
62.
In order to get more reliable electronic structure of protein in aqueous solution, it is necessary to construct a simple, easy-use equivalent potential of water molecules for protein's electronic structure calculation. The first-principles, all-electron, ab initio calculations have been performed to construct the equivalent potential of water molecules for the electronic structure of Cys. The process consists of three steps. First, the electronic structure of the cluster containing Cys and water molecules is calculated. Then, based on the structure, the electronic structure of Cys with the potential of water molecules is calculated using the self-consistent cluster-embedding method. Finally, the electronic structure of Cys with the potential of dipoles is calculated. The dipoles are adjusted so the electronic structure of Cys with the potential of dipoles is close to that of water molecules. The calculations show that the major effect of water molecules on Cys' electronic structure is lowering the occupied electronic states by about 0.032 Ry, and broadening energy gap by 16%. The effect of water molecules on the electronic structure of Cys can be simulated by dipoles potential.  相似文献   
63.
We investigate the electronic structure of bulk Sr2CoMoO6-δ double perovskites using the ab initio Full Potential Linearized Augmented Plane Wave method in order to study their magnetic properties within the GGA and GGA+U methods. We discuss the relative stability of ferromagnetic (FM) and antiferromagnetic (AFM) orders (i) without and with taking into account the observed tilting of the oxygen octahedra and (ii) by introducing oxygen vacancies. We show that a very good agreement with experimental results — AFM order for δ= 0 and FM order for δ= 1/2 — is obtained only when the tilting of the oxygen tetrahedra is taking into account and when the GGA+U method is used.  相似文献   
64.
The objective of this Letter is to provide an efficient and reliable analytical procedure for the generalized Bloch–Gruneisen function with the Debye temperatures for the wide temperature range using the binomial expansion theorems. As will be seen, the present formulation yields compact closed-form expressions which enable the ready calculation of Bloch–Gruneisen function for integer and noninteger values of parameter m. The proposed procedure guarantees the reliable application of the contribution of electron–photon interaction to the electrical resistivity of metals. Finally, the algorithm is used to simulate the variation of the resistivity and thermal conductivity against temperature sintered polycrystalline MgB2. Furthermore, the comparison of the method with numerical calculations demonstrates the applicability and accuracy of the method.  相似文献   
65.
Photoluminescence of ZnO ceramics irradiated with electrons of 0.8 MeV and 2.6 MeV energy has been investigated. The irradiated samples have been annealed in air at temperatures up to 1100° C. Irradiation causes quenching of the PL green band and as a consequence a peak at 470 nm emerges. Results indicate that part of the quenching can be attributed to damage in the oxygen sublattice.  相似文献   
66.
We investigate the structure and magneto-transport properties of thin films of the Co2Cr0.6Fe0.4Al full-Heusler compound, which is predicted to be a half-metal by first-principles theoretical calculations. Thin films are deposited by magnetron sputtering at room temperature on various substrates in order to tune the growth from polycrystalline on thermally oxidized Si substrates to highly textured and even epitaxial on MgO(001) substrates, respectively. Our Heusler films are magnetically very soft and ferromagnetic with Curie temperatures up to 630 K. The total magnetic moment is reduced compared to the theoretical bulk value, but still comparable to values reported for films grown at elevated temperature. Polycrystalline Heusler films combined with MgO barriers are incorporated into magnetic tunnel junctions and yield 37% magnetoresistance at room temperature.  相似文献   
67.
13C isotope has been separated in the form of enriched product C2F4 by selective multi-photon dissociation (MPD) of Freon-22 (CHClF2) using the 9P(26) laser line of a transversely excited atmospheric CO2 laser. The non-linearity factor, γ, that determines the dependence of the yield of 13C isotope on the fluence (J/cm2) has been determined for various laser rotational lines (9P(20)–9P(26)) and the advantage of a lower γ in the case of 9P(26) is highlighted for macroscopic production of 13C isotope. It is also shown that a higher value of the optimum fluence at 9P(26) not only results in a higher enrichment efficiency but in a relatively lower value of γ also. The laser pulse energy is efficiently utilized for selective MPD of Freon-22 by focusing the pulse energy repeatedly with the help of a novel linear multi-pass cavity (LMPC). The novelty of this optical arrangement lies in its ability to maintain the laser fluence around an optimum value for a desired enrichment of 13C in the product. This also ensures a higher quantity of enriched product because of the higher reaction volume. The advantage of the LMPC over the conventionally used Herriott multi-pass cell has also been presented. The gain in reaction volume in the present optical cavity having 20 passes with a constant fluence in each pass is as high as 12. Isotope-selective MPD of Freon in a LMPC with constant fluence in each pass showed a distinct advantage in energy utilization to separate 13C isotope over the gradually reducing fluence case.This revised version was published online in August 2005 with a corrected cover date.  相似文献   
68.
* fluorescence radiation from the ion–ion recombination process in the gas volume during the preionization phase, therefore allowing spatial resolution by partial imaging of the volume. Volume-integrated and temporally resolved measurements are carried out to determine the average of absolute preionization densities by comparison with a theoretical model of the temporal behaviour of the recombination process. Spatially resolved measurements reveal the distribution of the preionization density. The preionization densities determined from spark and sliding/corona discharges schemes are considerably higher (ne 0?1012 cm-3) than those obtained from pulsed X-ray preionization (ne 0?107 cm-3). Received: 3 October 1997/Revised version: 6 January 1998  相似文献   
69.
Intrinsic room-temperature ferromagnetism was detected over n-type carbon-doped ZnO prepared through solid-state reaction. Our results of first-principle calculations based on density functional theory revealed that the CZn4O12 unit is the origin of magnetic moment in the carbon-doped ZnO system. The carbon component has a significant contribution to the net magnetic moment, and any oxygen vacancy present in CZn4O12 has a negative effect on the magnetic properties of the system. Moreover, both antiferromagnetic and ferromagnetic interactions are predicted among carbon atoms located at different CC distances. The result suggests that the defect density influenced by the distribution of carbon has a significant effect on the magnetic properties of the carbon-doped ZnO system.  相似文献   
70.
Metamagnetism in layered ruthenates has been interpreted as a novel kind of quantum critical behavior. In an external magnetic field, Ca2-xSrxRuO4 undergoes a metamagnetic transition accompanied by a pronounced magnetostriction effect. In this paper we present a mean-field study for a microscopic model that naturally reproduces the key features of this system. The phase diagram calculated is equivalent to the experimental T-x phase diagram. The presented model also gives a good basis to discuss the critical metamagnetic behavior measured in the system.  相似文献   
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