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Charles W. Bauschlicher Jr. Cameron J. Bodenschatz Dwight L. Myers Nathan S. Jacobson 《Journal of the American Ceramic Society》2020,103(10):5870-5880
Thermodynamic parameters are reported for gaseous hydroxides and oxyhydroxides of Al, Zr, and Y. The structures and vibrational frequencies are calculated using density functional theory with the B3LYP functional. This yields entropies at 298.15 K and heat capacities. The enthalpies are calculated from appropriate reactions and the CCSD(T) (Coupled Cluster, Singles, Doubles, and perturbative Triples) approach. The hydroxide groups are treated as hindered rotors for all species. The results are compared to the limited experimental and theoretical calculations for these species. Finally, the data are put into a database for a free-energy minimizer and the vapor pressures for each species are compared. 相似文献
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In this paper, we study the melting of a spherical nanoparticle. The model differs from previous ones in that a number of features have been incorporated to match experimental observations. These include the size dependence of the latent heat and a cooling condition at the boundary (as opposed to the fixed temperature condition used in previous studies). Melt temperature variation and density change are also included. The density variation drives the flow of the outer fluid layer. The latent heat variation is modelled by a new relation, which matches experimental data better than previous models. A novel form of Stefan condition is used to determine the position of the melt front. This condition takes into account the latent heat variation, the energy required to create new surface and the kinetic energy of the displaced fluid layer. Results show that melting times can be significantly faster than predicted by previous theoretical models; for smaller particles, this can be around a factor 3. This is primarily due to the latent heat variation. The previously used fixed temperature boundary condition had two opposing effects on melt times: the implied infinite heat transfer led to faster melting but also artificially magnified the effect of kinetic energy, which slowed down the process. We conclude that any future models of nanoparticle melting must be based on the new Stefan condition and account for latent heat variation. 相似文献
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Journal of Applied Electrochemistry - We have developed a methodology for electrohydrodynamic printing of a nitric oxide (NO) sensor. The primary features of this amperometric methodology include... 相似文献
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Differential effects of air conditioning type on residential endotoxin levels in a semi‐arid climate 下载免费PDF全文
J. D. Johnston B. A. Kruman M. C. Nelson R. M. Merrill R. J. Graul T. G. Hoybjerg S. C. Tuttle S. J. Myers R. B. Cook K. S. Weber 《Indoor air》2017,27(5):946-954
Residential endotoxin exposure is associated with protective and pathogenic health outcomes. Evaporative coolers, an energy‐efficient type of air conditioner used in dry climates, are a potential source of indoor endotoxins; however, this association is largely unstudied. We collected settled dust biannually from four locations in homes with evaporative coolers (n=18) and central air conditioners (n=22) in Utah County, Utah (USA), during winter (Jan‐Apr) and summer (Aug‐Sept), 2014. Dust samples (n=281) were analyzed by the Limulus amebocyte lysate test. Housing factors were measured by survey, and indoor temperature and relative humidity measures were collected during both seasons. Endotoxin concentrations (EU/mg) were significantly higher in homes with evaporative coolers from mattress and bedroom floor samples during both seasons. Endotoxin surface loads (EU/m2) were significantly higher in homes with evaporative coolers from mattress and bedroom floor samples during both seasons and in upholstered furniture during winter. For the nine significant season‐by‐location comparisons, EU/mg and EU/m2 were approximately three to six times greater in homes using evaporative coolers. A plausible explanation for these findings is that evaporative coolers serve as a reservoir and distribution system for Gram‐negative bacteria or their cell wall components in homes. 相似文献
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A few studies suggest that drivers with Parkinson's disease (PD) may self-regulate or modify their driving behavior more than drivers without neurological disorders; however findings are limited to self-report. The purpose of this study was to objectively examine whether drivers with PD show more restrictive driving practices (exposure and patterns). Electronic devices were installed in the vehicles of 27 drivers with PD (71.6 ± 6.6; 78% men) and 20 matched controls (70.6 ± 7.9; 80% men) for two weeks and driving data were matched with aerial maps, weather and daylight archives and trip logs to examine driving context. Compared to controls, the PD group drove significantly less overall (number of trips, kilometres, duration), and proportionately less at night and on days with bad weather suggesting more restricted driving practices, congruent with lower ratings of driving comfort and abilities. However, they may not necessarily drive more cautiously or safely as they drove significantly faster (and over the speed limit) on highways and freeways and 19% reported driving problems over the two weeks. These preliminary findings need to be replicated and longitudinal studies using objective indicators are needed to examine changes in driving practices, as well as crash outcomes, as disease severity progresses. 相似文献
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In estimating a response surface where the k variables represent proportions in a mixture, the experimenter is often interested in a reasonably well-defined region of interest which may, for example, center about current operating levels. Previously developed designs are difficult to use except in exploring the entire factor space, and even then there are several disadvantages to these designs. A general method of constructing designs from familiar response surface designs in k ? 1 independent variables and the appropriate analysis for a general polynomial is given. Special attention is given to the first and second order polynomials. 相似文献