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1.
The electronic and structural characteristics of CrF5, CrF4, RuF5 and RuF4 were studied. Ab initio (SCF-CI) calculations were performed with different structures and spin states for each complex. The favored conformation always corresponds to the highest multiplicity: doublet for CrF5 in D3h, triplet for CrF4 in Td, quadruplet for RuF5 in C4v and quintuplet for RuF4 in D4h symmetry.  相似文献   
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The photoelectronic spectra of cis-2-chloro, 4-tert-butylcyclohexanone and cis-2-methyl-2-chlorocyclohexanone have been analysed. These analyses have been used in an investigation into the nature of the orbital interactions in these molecules, and into the dependence of these interactions on the axial or equatorial position of the halogen atom. The preferential conformations of 2-chlorocyclohexanone and 4,4-dimethyl-2-chlorocyclo-hexanone have thus been obtained.  相似文献   
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The purpose of this project was to prepare fluorescent dyes that could absorb energy at relatively short wavelengths, and fluoresce in the near-IR region. To achieve this, copper- and palladium-mediated C-N couplings were used to prepare the ‘cassettes’, i.e the carbazole derivative 3b and the carbazole-, phenothiazine-, and phenoazine-squaraines 4b-d. These compounds have carbazole, phenothiazine, and phenoazine donor-components that absorb around about 300-320 nm, and squaraine acceptor-parts that fluoresce in the range 650-700 nm. The efficiencies of energy transfer from the donor to the acceptor, and the overall quantum yields of the cassettes were determined.  相似文献   
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We review recent findings about the behavior of emulsions made of droplets suspended in liquid crystalline materials. By contrast to classical emulsions, which are usually made of isotropic oils and water, liquid crystal emulsions exhibit a variety of structures result in the ordering of the continuous phase. The droplets induce the formation of topological defects and distortions that lead to strong and anisotropic elastic forces between the particles. These elastic forces govern the stability and the ordering of the particles. This is observed in aqueous emulsions as well as in non-aqueous emulsions obtained from phase separation phenomena. It is shown that phase separations in liquid crystals can lead to the formation of highly ordered arrays of uniformly sized droplets. More generally, ordered structures seen in liquid crystal emulsions are of interest as examples of topologicallv-controlled organizations; they are also of potential practical importance as a novel way to control both the stability and the structures of colloidal particles.  相似文献   
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Background  

There is great interest in appropriate phenotypes that serve as indicator of genetically transmitted frontal (dys)function, such as ADHD. Here we investigate the ability to deal with response conflict, and we ask to what extent performance variation on response interference tasks is caused by genetic variation. We tested a large sample of 12-year old monozygotic and dizygotic twins on two well-known and closely related response interference tasks; the color Stroop task and the Eriksen flanker task. Using structural equation modelling we assessed the heritability of several performance indices derived from those tasks.  相似文献   
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Background  

In the field of auditory neuroscience, much research has focused on the neural processes underlying human sound localization. A recent magnetoencephalography (MEG) study investigated localization-related brain activity by measuring the N1m event-related response originating in the auditory cortex. It was found that the dynamic range of the right-hemispheric N1m response, defined as the mean difference in response magnitude between contralateral and ipsilateral stimulation, reflects cortical activity related to the discrimination of horizontal sound direction. Interestingly, the results also suggested that the presence of realistic spectral information within horizontally located spatial sounds resulted in a larger right-hemispheric N1m dynamic range. Spectral cues being predominant at high frequencies, the present study further investigated the issue by removing frequencies from the spatial stimuli with low-pass filtering. This resulted in a stepwise elimination of direction-specific spectral information. Interaural time and level differences were kept constant. The original, unfiltered stimuli were broadband noise signals presented from five frontal horizontal directions and binaurally recorded for eight human subjects with miniature microphones placed in each subject's ear canals. Stimuli were presented to the subjects during MEG registration and in a behavioral listening experiment.  相似文献   
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