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排序方式: 共有91条查询结果,搜索用时 46 毫秒
41.
Ramzi Hammami Narjes Harrouch Batis Habib Batis Christian Minot 《Solid State Sciences》2009,11(4):885-893
Cation-deficient lanthanum manganite oxides with 0.8 ≤ La/Mn ≤ 1.25 were synthesized using a multi-step decomposition of gel precursors and investigated from experimental and theoretical point of view. The XRD (X-Ray Diffraction) analysis of the mixed LaMnO3 oxide crystal concludes to a hexagonal structure, space group R-3c, excluding the presence of pure oxides such as La2O3, Mn2O3, or MnO2 whatever the ratio La/Mn is. Oxides with nominal formulae La1?xMnO3+y and LaMn1?x′O3+y contain more than one defect structure involving valence defect (holes h), anionic vacancies as well as cationic vacancies in A and B sublattices of the perovskite structure. With the increase of La or Mn non-stoichiometry, the oxygen content y decreases more with La-deficient compositions than with Mn-deficient ones. The La/Mn ratio influences strongly the relationship between [h], [VO], [VLa?] and [VMn?].The DFT-GGA (Density functional Theory, Generalized-Gradient Approximation) simulation of these compounds using VASP (Vienna Ab-initio Simulation Package) concludes that the electronic structure for the optimized stoichiometric La6Mn6O18 is not optimal, relative to that expected considering Mn(III) ions with four alpha electrons each. The non-stoichiometry is the easiest way of reducing the Jahn–Teller instability by depopulating the half-filled eg orbitals. A partial oxidation is then stabilizing. Creation of defects, either an O insertion or a cationic vacancy, allows finding an ideal count. In the case of pure cationic defects (missing a La(III) or a Mn(III) cation), the amount of vacancies is one missing cation upon twelve. The compact nature of lanthanum manganite oxide does not allow oxygen insertion within the bulk structure and oxidation can only be achieved at the surface without O penetration. The formation of antisites is endothermic. The creation of mixed vicinal vacancies, one oxygen and one cationic vacancy (La or Mn), is exothermic for a concentration of defects of one defect per twelve cations. 相似文献
42.
Ramzi May 《Bulletin des Sciences Mathématiques》2009,133(8):817-836
In a recent work [P.G. Lemarié-Rieusset, Uniqueness for the Navier–Stokes problem: Remarks on a theorem of Jean-Yves Chemin, Nonlinearity 20 (2007) 1475–1490], P.G. Lemarié-Rieusset proved the uniqueness of solution to the Navier–Stokes equations in the space provided that p>2 and q>d. In this paper, we prove a local version of this result which covers the limit case q=d. Precisely, we prove the uniqueness of solution to the Navier–Stokes equations in the space for every p>2 and r>2 where is the closure of the test functions in the Morrey–Campanato space Mr,d(Rd). The prove of our result relies on an extension of the Comparison Theorem of P.G. Lemarié-Rieusset (Theorem 21.1 in [P.G. Lemarié-Rieusset, Recent developments in the Navier–Stokes problem, Chapman & Hall/CRC, 2002]). Moreover, this extension allows us to prove the uniqueness of solution to the Navier–Stokes equations in a functional space closed to the critical space C([0,T],M2,d(Rd)). 相似文献
43.
Kamel Damak Ramzi Maâlej El Sayed Yousef Abdulla H. Qusti Christian Rüssel 《Journal of Non》2012,358(22):2974-2980
In this work a transparent bulk glass with the mol% composition 76TeO2·10ZnO·9.0PbO·1.0PbF2·3.0Na2O doped with Tm3 + has been synthesized. Results of differential thermal analysis (DTA) indicate a high thermal stability and low tendency to crystallization of this glass. The refractive indices at different wavelengths, the Urbach energy, the optical energy gap, the Sellmeier gap energy and the dispersion energy have been estimated. Spectroscopic quality factor of Tm3 + was evaluated from optical absorption spectra. Electric and magnetic dipole transition probabilities, branching ratios, and radiative lifetimes of several excited states of Tm3 + have been predicted using calculated intensity Judd–Ofelt parameters. The classical McCumber theory has been applied to evaluate the emission cross-sections for 3F4 → 3H6 transition around 1.8 μm. This study shows that TZPPN glass doped with Tm3 + ions is a promising candidate for laser applications. 相似文献
44.
Kearley GJ Stare J Kutteh R Daemen LL Hartl MA Eckert J 《The journal of physical chemistry. A》2012,116(9):2283-2291
We analyze the interplay between proton transfer in the hydrogen-bond bridge, O···H···O, and lattice dynamics in the model system tetraacetylethane (TAE) (CH(3)CO)(2)CH═CH(COCH(3))(2) using density functional theory. Lattice dynamics calculations and molecular dynamics simulations are validated against neutron scattering data. Hindrance to the cooperative reorientation of neighboring methyl groups at low temperatures gives a preferred O atom for the bridging proton. The amplitude of methyl torsions becomes larger with increasing temperature, so that the free-energy minimum for the proton becomes flat over 0.2 ?. For the isolated molecule, however, we show an almost temperature-independent symmetric double-well potential persists. This difference arises from the much higher barriers to methyl torsion in the crystal that make the region of torsional phase space that is most crucial for symmetrization poorly accessible. Consequently, the proton-transfer potential remains asymmetric though flat at the base, even at room temperature in the solid. 相似文献
45.
46.
Jean-Christophe Petiteau Ramzi Othman Pierrick Guégan Hervé Le Sourne Erwan Verron 《Polymer Testing》2013,32(2):394-401
Elastomers are widely used for damping components in various industrial contexts because of their remarkable dissipative properties: they can bear severe mechanical loading conditions, i.e., high strain rates and large strains. Depending on the strain rate, the mechanical response of these materials can vary from purely rubber-like to glassy. In the intermediate strain rate range (1-100/s), uniaxial extension experiments are classically conducted at constant nominal strain rate. We present here a new experimental methodology to investigate the mechanical response of soft materials at constant true strain rate in the intermediate strain rate range. For this purpose, the displacement imposed on the specimen by the tensile machine is an exponential function of time. A high speed servo-hydraulic machine is used to perform experiments at strain rates ranging from 0.01 to 100/s. A specific specimen is designed in order to achieve a uniform strain field (and thus a uniform stress field). Furthermore, an instrumented aluminium bar is used to measure the applied force; which overcomes the difficulties due to dynamic effects. Simultaneously, a high speed camera enables the measurement of strain in the sample using a point tracking technique. Finally, the method is applied to determine the stress-strain curve of an elastomer for both loading and unloading responses up to a stretch ratio λ = 2.5; the influence of the true strain rate on both stiffness and dissipation of the material is then discussed. 相似文献
47.
Amran AB Majid Aznan Fazli Ismail Muhamad Samudi Yasir Redzuwan Yahaya Ismail Bahari 《Journal of Radioanalytical and Nuclear Chemistry》2013,297(2):277-284
Previous studies have shown that the natural radioactivity contained in building materials have significantly influenced the dose rates in dwelling. Exposure to natural radiation in building has been of concerned since almost 80 % of our daily live are spend indoor. Thus, the aim of the study is to assess the radiological risk associated by natural radioactivity in soil based building materials to dwellers. A total of 13 Portland cement, 46 sand and 43 gravel samples obtained from manufacturers or bought directly from local hardware stores in Peninsular of Malaysia were analysed for their radioactivity concentrations. The activity concentrations of 226Ra, 232Th and 40K in the studied building materials samples were found to be in the range of 3.7–359.3, 2.0–370.8 and 10.3–1,949.5 Bq kg?1 respectively. The annual radiation dose rates (μSv year?1) received by dwellers were evaluated for 1 to 50 years of exposure using Resrad-Build Computer Code based on the activity concentration of 226Ra, 232Th and 40K found in the studied building material samples. The rooms modelling were based on the changing parameters of concrete wall thickness and the room dimensions. The annual radiation dose rates to dwellers were found to increase annually over a period of 50 years. The concrete thicknesses were found to have significantly influenced the dose rates in building. The self-absorption occurred when the concrete thickness was thicker than 0.4 m. Results of this study shows that the dose rates received by the dwellers of the building are proportional to the size of the room. In general the study concludes that concrete building materials; Portland cements, sands, and gravels in Peninsular of Malaysia does not pose radiological hazard to the building dwellers. 相似文献
48.
Sudharshan Prabhu Rekha PD Chiu-Chung Young Asif Hameed Shih-Yao Lin Arun AB 《Applied biochemistry and biotechnology》2013,171(4):817-831
Zeaxanthin carotenoids are class of commercially important natural products and diverse biomolecules produced by plants and many microorganisms. Bacteria often produce a cocktail of polar and nonpolar carotenoids limiting their industrial applications. Marine members of the family Flavobacteriaceae are known to produce potential carotenoids such as astaxanthin and zeaxanthin. A few bacterial species have been reported for the predominant production zeaxanthin. Here, we report the molecular identification of the zeaxanthin as a major carotenoid produced by two novel bacteria (YUAB-SO-11 and YUAB-SO-45) isolated from sandy beaches of South West Coast of India and the effect of carbon sources on the production of zeaxanthin. The strains were identified based on the 16S rRNA gene sequencing as a member of genus Muricauda. The closest relatives of YUAB-SO-11 and YUAB-SO-45 were Muricauda aquimarina (JCM 11811T) (98.9 %) and Muricauda olearia (JCM 15563T) (99.2 %), respectively, indicating that both of these strains might represent a novel species. The highest level of zeaxanthin production was achieved (YUAB-SO-11, 1.20?±?0.11 mg g?1) and (YUAB-SO-45, 1.02?±?0.13 mg g?1) when cultivated in marine broth supplemented with 2 % NaCl (pH 7) and incubated at 30 °C. Addition of 0.1 M glutamic acid, an intermediate of citric acid cycle, enhanced the zeaxanthin production as 18 and 14 % by the strains YUAB-SO-11 and YUAB-SO-45 respectively. The zeaxanthin showed in vitro nitric oxide scavenging, inhibition of lipid peroxidation, and 2,2-diphenyl-1-picryl hydrazyl scavenging activities higher than the commercial zeaxanthin. The results of this study suggest that two novel strains YUAB-SO-11 and YUAB-SO-45 belonging to genus Muricauda produce zeaxanthin as a predominant carotenoid, and higher production of zeaxanthin was achieved on glutamic acid supplementation. The pigment showed good in vitro antioxidant activity, which can be exploited further for commercial applications. 相似文献
49.
Luminescence spectra of erbium ions doped in Y2O3-P2O5 thin films, with different P2O5 content (from 3% to 47%), were analysed with crystal-field Hamiltonian model with D2d symmetry including J-mixing effect. The empirical crystal-field parameters (CFPs) obtained for the best fit of calculated to experimental energy levels allows us to confirm the well-established YPO4 phase for 47% of P2O5. The CFPs are compared to those calculated for Ce3+, Nd3+ and Dy3+ in the YPO4 host. This work is a continuation of our previous results for erbium-doped Y2O3 thin films. 相似文献
50.
The essential oils of the aerial part of two Asteraceae species, namely Euryops arabicus Steud. and Laggera decurrens (Vahl.) Hepper and Wood, were studied by GC and GC/MS. In parallel the antimicrobial and antioxidant activities were evaluated. The investigation led to the identification of 48 and 44 compounds for both plants, respectively. The essential oil of E. arabicus was rich in oxygenated sesquiterpenes (39.9%). The oil also contained a high content of sesquiterpene hydrocarbons (24.1%). Compounds such as caryophyllene oxide (8.6%), T-cadinol (7.0%), spathulenol (5.2%), (E)-β-caryophyllene (6.0%) and 2-epi-(E)-β-caryophyllene (6.0%) were the main constituents of the oil. Oxygenated monoterpenes also predominated in L. decurrens (46.3%). The thymoquinone-derivative, 3-methoxy-2-methyl-5-(1-methylethyl)-2,5-cyclohexadiene-1,4-dione (28.1%), thymol (5.7%) and eudesma-11-en-4a-ol (7.0%) were the most abundant constituents. Both essential oils showed antimicrobial activity with MIC-values between 0.13-5.25 mg/mL. Furthermore, only the essential oil of L. decurrens exhibited a strong antioxidant activity (91%) at 500 μg/mL. 相似文献