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The European Physical Journal E - A two-dimensional multiphase cellular automaton (CA) model is proposed for the prediction of growth kinetics and microstructural evolution during peritectic...  相似文献   
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A polyurea macromer (PUM) was synthesized and dispersed in basic conditions to form self‐assembled nanoparticles (<20 nm dispersions, up to 30 wt % aq. soln.). These nanoparticles enabled surfactant‐free emulsion polymerization to form hybrid polyurea‐acrylic particles despite the absence of a measureable water‐soluble fraction. The Tg of the starting PUM material was a strong function of the PUM's extent of neutralization and hydration (varying between 100 °C and >175 °C) due to changes in hydrogen and ionic bonding. Two separate hybrid polyurea‐acrylic emulsion systems were prepared: one by direct polymerization of (meth)acrylic monomers in the presence of the nanodispersion and a second by a physical blend of PUM nanodispersion with an acrylic latex control. The direct polymerization method resulted in a hybrid emulsion particle size that developed by a mechanism resembling conventional emulsion polymerization and was unlike that described for seeded polyurethane dispersion systems. Film hardness was shown to increase with increasing coating thickness for the hybrid film prepared by direct polymerization. The resulting mechanical properties could be explained by applying mechanical models for a composite foam structure. These results were unprecedented for normal elastomer films. © 2019 Wiley Periodicals, Inc. J. Polym. Sci., Part A: Polym. Chem. 2019, 57, 1373–1388  相似文献   
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The hydroformylation of propene to give predominantly iso‐butanal has been achieved; class‐leading selectivity is possible even at higher temperatures that deliver fast conversion. Racemic rhodium complexes of bidentate phospholane phosphites derived from tropos‐biphenols and unusual solvent systems are the key to the selectivity observed.  相似文献   
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The authors have studied the microphase separation of symmetric diblock copolymers with variable block stiffness and different block chain lengths using coarse-grained molecular dynamics simulations. The simulation results show that for symmetric diblock copolymers, a combination of chain length and relative stiffness between the blocks may play the major role in determining the equilibrium morphology of the system. When the variation in stiffness between blocks is small, the equilibrium morphology of the diblock system is found to be lamellar; this is also the case for systems with small chain lengths, regardless of the difference in block stiffness. However, in systems with longer chains with modest variation in stiffness between the blocks, an ordered cylindrical phase is formed in which the stiffer blocks form cylinders completely surrounded by the flexible components. © 2009 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys 47: 2556–2565, 2009  相似文献   
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Summary The aquation kinetics of [Co(Py)4Cl2]X salts (X=Cl, NO 3 , IO 4 , ClO 4 , SCN and N 3 ) in EtOH/H2O have been widely investigated over a range of solvent compositions. Similarly, the aquation rate constants were determined in aqueous solution (11 v/v) containing other organic solvents. The study reveals the existence of specine solvation of the activated complex and that the rate constant associated with the rate-determining step of the reaction depends to some extent on the ionizing power of the medium. The influence of the counter ions on the aquation rate is also discussed. Basicity, the capacity of the nucleophiles to abstract the exchangeable proton from a titanium selenite inorganic exchanger was found to follow the order: SCN3 4 4 3 .  相似文献   
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Mesfin Asfaw 《Physica A》2007,384(2):346-358
We model a tiny heat engine as a Brownian particle that moves in a viscous medium in a sawtooth potential (with or without load) assisted by alternately placed hot and cold heat baths along its path. We find closed form expression for the steady-state current as a function of the model parameters. This enables us to deal with the energetics of the model and evaluate either its efficiency or its coefficient of performance depending upon whether the model functions either as a heat engine or as a refrigerator, respectively. We also study the way current changes with changes in parameters of interest. When we plot the phase diagrams showing the way the model operates, we not only find regions where it functions as a heat engine and as a refrigerator but we also identify a region where the model functions as neither of the two.  相似文献   
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We report a surprisingly strong ordering of Si-(CH(3))(2) groups upon confinement between two surfaces, an oxidized poly(dimethyl siloxane) (PDMS(ox)) elastomer and a methyl-terminated self-assembled monolayer (octadecyltrichlorosilane (OTS)) on sapphire substrates. This enhanced ordering is induced by the template of ordered methyl groups of OTS and is not observed for other surfaces (fluorinated monolayers and sapphire substrates). This strong ordering is reminiscent of layering observed for confined symmetric molecules between two mica surfaces but was expected to vanish between rough macroscopic surfaces. These results provide new insights on confined structure at the interface between two solids and are important in the understanding of surface-controlled processes of practical importance.  相似文献   
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The dicationic Ir(III) complex [IrMe(CO)(dppe)(DIB)](BARF)2 having adjacent labile sites has been found to be a very effective catalyst for promoting the Nazarov cyclization of aryl vinyl and divinyl ketones. Spectroscopic evidence for a substate-catalyst complex before cyclization is presented. The efficiency of the cyclization is attributed to the electrophilicity of the Ir(III) complex and substrate activation via chelation.  相似文献   
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