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91.
Wilder Carrillo-Cabrera Horst Borrmann Silke Paschen Michael Baenitz Frank Steglich Yuri Grin 《Journal of solid state chemistry》2005,178(3):715-728
In order to find the optimal conditions for sample preparation of the binary germanide Ba6Ge25, the germanium-rich part of the Ba-Ge phase diagram was redetermined by means of metallography, X-ray powder diffraction and differential thermal analysis. The temperature behavior of cubic Ba6Ge25 was investigated both on polycrystalline samples and single crystals. The temperature dependence of the lattice parameter exhibits two anomalies at about 180 and 230 K, respectively, which are caused by a structure transformation in two steps with hysteresis. Powder (T=10-295 K) and single-crystal (T=95-295 K) X-ray diffraction studies confirm that the symmetry of Ba6Ge25 (space group P4132) remains unchanged within the entire temperature range. A reconstructive behavior of the structural transformation is observed, involving Ge-Ge bond breaking and barium cation displacements. Some Ge4 type atoms (∼28%) are so significantly displaced during cooling that Ge4-Ge6 bonds break and new three-bonded (3b)Ge− species (electron acceptors) are formed. Consequently, the number of charge carriers is reduced, affecting the physical properties. The reversible bond breaking involved in this process is a typical characteristic of a solid-state chemical reaction. 相似文献
92.
Manuel Gentzen Dmitry E. Doronkin Thomas L. Sheppard Anna Zimina Haisheng Li Jelena Jelic Felix Studt Jan‐Dierk Grunwaldt Jrg Sauer Silke Behrens 《Angewandte Chemie (Weinheim an der Bergstrasse, Germany)》2019,131(44):15802-15806
The single‐step syngas‐to‐dimethyl ether (STD) process entails economic and technical advantages over the current industrial two‐step process. Pd/ZnO‐based catalysts have recently emerged as interesting alternatives to currently used Cu/ZnO/Al2O3 catalysts, but the nature of the active site(s), the reaction mechanism, and the role of Pd and ZnO in the solid catalyst are not well established. Now, Zn‐stabilized Pd colloids with a size of 2 nm served as the key building blocks for the methanol active component in bifunctional Pd/ZnO‐γ‐Al2O3 catalysts. The catalysts were characterized by combining high‐pressure operando X‐ray absorption spectroscopy and DFT calculations. The enhanced stability, longevity, and high dimethyl ether selectivity observed makes Pd/ZnO‐γ‐Al2O3 an effective alternative system for the STD process compared to Cu/ZnO/γ‐Al2O3. 相似文献
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For any weighted space HV(G) of holomorphic functions on an open set G ? ?Nwith a topology stronger than that of uniform convergence on the compact sets and for any quasibarrelled space E we prove the topological isomorphism $HV(G,E_{b}^{\prime})={\cal L}_b(E,HV(G))$ and derive a similar, more complicated isomorphism for weighted spaces of continuous functions. This generalizes results of [3], [7] and [6] and should be compared with the ∈-product representations for the corresponding spaces of functions with o-growth conditions. At the end we also show the topological isomorphism HV1(G1, HV2(G2)) = H (V1 ? V2)(G1 × G2). 相似文献
96.
Holger Lang Margarete Gottlieb Michael Schwarz Silke Farkas BerndS. Schulz Frank Himmelsbach Ramamurthy Charubala Wolfgang Pfleiderer 《Helvetica chimica acta》1999,82(12):2172-2185
A series of new base-protected and 5′-O-(4-monomethoxytrityl)- or 5′-O-(4,4′-dimethoxytrityl)-substituted 3′-(2-cyanoethyl diisopropylphosphoramidites) and 3′-[2-(4-nitrophenyl)ethyl diisopropylphosphoramidites] 52 – 66 and 67 – 82 , respectively, are prepared as potential building blocks for oligonucleotide synthesis (see Scheme). Thus, 3′,5′-di-O-acyl- and N 2,3′-O,5′-O-triacyl-2′-deoxyguanosines can easily be converted into the corresponding O6-alkyl derivatives 6 , 8 , 10 , 12 , 14 , and 16 by a Mitsunobu reaction using the appropriate alcohol. Mild hydrolysis removes the acyl groups from the sugar moiety (→ 9 , 11 , 13 , 15 , and 19 (via 18 ), resp.) which can then be tritylated (→ 38 – 42 ) and phosphitylated (→ 57 – 61 ) in the usual manner. N 2-[2-(4-nitrophenyl)ethoxycarbonyl]-substituted and N 2-[2-(4-nitrophenyl)ethoxycarbonyl]-O6-[2-(4-nitrophenyl)ethyl]-substituted 2′-deoxyguanosines 5 and 7 , respectively, are synthesized as new starting materials for tritylation (→ 28 , 35 , and 37 ) and phosphitylation (→ 54 , 56 , 70 , and 78 ). Various O4-alkylthymidines (see 20 – 24 ) are also converted to their 5′-O-dimethoxytrityl derivatives (see 43 – 47) and the corresponding phosphoramidites (see 62 – 66 and 79 – 82 ). 相似文献
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99.
Silke Tesch Karl-Heinz Rentrop Matthias Otto 《Fresenius' Journal of Analytical Chemistry》1992,344(4-5):206-208
Summary A method for the rapid characterization of brown coals based on the application of a powerful method of principal component analysis, the Partial Least Squares method (PLS), is described. A data catalogue of 44 brown coals from different deposits of East European and Asian countries was used, which lists analyses of several coal parameters. Infrared spectra of brown coals were recorded and different coal properties were predicted with the help of PLS. The results show that, with the PLS-method used, several coal properties can be predicted and it is possible to describe the classification of a coal for several technological processes. The developed method is useful because of the multiplicity of information obtained within a short time and because it is possible to replace lengthy classical methods. 相似文献
100.
Bräuer S Almstetter M Antuch W Behnke D Taube R Furer P Hess S 《Journal of combinatorial chemistry》2005,7(2):218-226
A genetic algorithm (GA), driven by experimentally determined biological activities as a feedback fitness function, was used to propose novel small molecules as inhibitors of glucose-6-phosphate translocase (G6PT) in iterative rounds of evolutionary optimization. A straightforward polymer-supported synthetic sequence was implemented to synthesize molecules proposed by the GA, and the biological activities of the compounds were determined by a microsomal assay. Additional compound design strategies were integrated, such as Tanimoto similarity-based selection of starting materials and transfer of favored structure elements into a new chemical scaffold to identify more active and selective inhibitors. 相似文献