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1.
2.
F. Trani G. Cantele D. Ninno G. Iadonisi 《Physica E: Low-dimensional Systems and Nanostructures》2004,22(4):808-814
In this paper we report on tight-binding calculations of lowest unoccupied molecular orbitals states for silicon ellipsoidal nanocrystals. The electronic structure has been calculated for different nanocrystal shapes either keeping constant or varying the number of silicon atoms. We have found that changing the ellipsoid aspect ratio a non-obvious energy level structure is obtained. The implications for the infrared optical transitions and their relationship with the polarization of the radiation involved are discussed. 相似文献
3.
Marco Lehmann-Waffenschmidt 《Central European Journal of Operations Research》2006,14(3):289-298
It is routine to demonstrate in the exchange economy framework that small changes of individual preferences and endowments always result in small changes of the derived excess demand functions as one should expect. Though being as desirable for reasons of the consistency of the whole approach, however, a precise proof of the converse direction so far is still open to question. The present paper shows that it is actually true. We use a decomposition method for aggregate excess demand functions developed by Mas-Colell which is derived from the well-known decomposition method developed by Sonnenschein and perfected by Debreu and Mantel. Our result fills in a notorious gap in the line of economic justification usually given for this decomposition, or disaggregation, method in that comparative static analysis would be restricted if the decomposition of excess demand functions would not be continuous. 相似文献
4.
LI Ya-feng~ ** ZHANG Li-mei~ WU Lei-lei~ WANG Sheng-hai~ WANG Hai-lian~ SHANG Xuan-xuan~ . College of Chemistry Molecular Engineering . College of Mathematics Physics Qingdao University of Science & Technology Qingdao P. R. China 《高等学校化学研究》2006,(6)
IntroductionThe interest in polyoxometalates that are widelyused in medical chemistry, catalyst reactions, and ma-terial sciences stems from their complicated aggregatesformed by means of corner-, edge- and face-sha-ring[1—4]. The exploitation of new str… 相似文献
5.
Michihiro Shirakawa 《Tetrahedron》2006,62(9):2016-2024
New porphyrin-based gelators bearing eight hydrogen-bond-forming amide groups at their periphery were synthesized. They acted as versatile gelators for aromatic solvents. SEM and TEM observations and X-ray crystallographic analysis established that they tend to aggregate into a two-dimensional sheet-like structure utilizing the intermolecular hydrogen-bonding interaction. In this structure the porphyrin-porphyrin π-π stacking interaction is not involved because of the energetically-predominant hydrogen-bonding interactions, keeping the space distance of 12.9 Å. Very interestingly, when C60 was added, the morphology was transformed to a one-dimensional fibrous structure, which can enjoy a porphyrin-C60-porphyrin interaction. This multicapsular structure having porphyrin-based compartments for hosting C60 was further characterized by XRD, EPR of a Cu(II) analogue, and the theoretical calculation. Thus, this paper presents a new concept, ‘molecular recognition in gel’, which is effective for the weak host-guest interaction. 相似文献
6.
7.
Ionic elastomers based on carboxylated nitrile rubber (XNBR) crosslinked with magnesium oxide (OMg) and filled with layered nanoclays have been prepared. Two types of nanofillers were employed: a commercial one (Cloisite 15 A) and the other prepared in our laboratory (BCA-ODA). The properties of raw and vulcanized compounds have been studied in order to elucidate the effect of layered nanoclays. X-ray diffraction analysis shows that during compounding and crosslinking the macromolecular chains of rubber were intercalated in a commercial nanofiller, whilst our nanoclay was exfoliated. However, this fact does not affect the properties of compounds homogeneously. Vulcanization parameters, Mooney viscosity and decay and rheological properties were affected depending on the filler type. Mechanical properties were not significantly varied, but glass transition temperature and ionic transition temperature were shifted in comparison with those of the unfilled compound. 相似文献
8.
Guan Wu WANG* Li Juan JIAO Er Hong HAO Yong Ming LU You Jun YANG Department of Chemistry University of Science Technology of China Hefei 《中国化学快报》2004,15(5)
Water-soluble fullerenes not only have a number of important applications in biological chemistry1, but also form ordered aggregate structures that can be utilized in materials science2. There are reports that some water-soluble fullerene derivatives can form ordered structures in water, such as vesicle, nanorod and nanoparticle2-5. However, relatively few reports on the aggregation process have been reported. Knowledge of factors that affect the cluster formation in solution is of consider… 相似文献
9.
A.M. El-Badry T. Kuroyanagi S. Mitarai A. Odahara Y. Gono S. Morinobu K. Ogawa 《The European Physical Journal A - Hadrons and Nuclei》1998,3(2):133-138
A recoil distance method was used to measure half-lives of the excited states of 145Sm. The reaction used was 139La(10B, 4n)145Sm. A plunger system was used. Half-lives were determined for two excited states for the first time. The yrast 27/2+ state was found to have a half-life of 1.1 ± 0.2 ns corresponding to the retardation of 3.1 × 10−4 comparing with the single particle estimate of M1. The excitation energy of this state was well reproduced by the shell model
calculation having a mixed configuration of [π{h11/2(g7/2)−2 (d5/2)−1}10−, νf7/2] + [π{h11/2(g7/2)−1}9−,νh9/2]. Another retarded E1 transition was also found in a decay of a 21/2+ state. Its retardation was 1.6 × 10−4 comparing with the single particle value.
Received: 9 September 1997 / Revised version: 12 June 1998 相似文献
10.
Y.K. Gambhir J.P. Maharana C.S. Warke 《The European Physical Journal A - Hadrons and Nuclei》1998,3(3):255-262
The existence of broken pseudo-spin symmetry in the Pb nucleus has been studied in the relativistic mean field approach using
realistic Lagrangian parameters. Its relationship to spin orbit splitting and the vanishingly small surface delta character
of the mean spin orbit potential are investigated. In the 208Pb nucleus the broken pseudo-spin doublets are found to exist above the neutron (proton) Fermi surfaces.
Received: 16 April 1998 / Revised version: 26 June 1998 相似文献