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A cost‐effective curvature calculation approach for interfacial flows on unstructured meshes 下载免费PDF全文
We present a simple and cost‐effective curvature calculation approach for simulations of interfacial flows on structured and unstructured grids. The interface is defined using volume fractions, and the interface curvature is obtained as a function of the gradients of volume fractions. The gradient computation is based on a recently proposed gradient recovery method that mimicks the least squares approach without the need to solve a system of equations and is quite easy to implement on arbitrary polygonal meshes. The resulting interface curvature is used in a continuum surface force formulation within the framework of a well‐balanced finite‐volume algorithm to simulate multiphase flows dominated by surface tension. We show that the proposed curvature calculation is at least as accurate as some of the existing approaches on unstructured meshes while being straightforward to implement on any mesh topology. Numerical investigations also show that spurious currents in stationary problems that are dependent on the curvature calculation methodology are also acceptably low using the proposed approach. Studies on capillary waves and rising bubbles in viscous flows lend credence to the ability of the proposed method as an inexpensive, robust, and reasonably accurate approach for curvature calculation and numerical simulation of multiphase flows. 相似文献
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This review examines the most recent electrochemical developments for nitrate, nitrite and ammonium detection for on-site water monitoring. There remains a high demand for effective field-based detection of the dissolved inorganic nitrogen (DIN) analytes to aid in mitigating nitrogen loading. Electrochemical approaches show increasing potential to fill this role as advancements in nanotechnology continually improve analytical performance and on-site applicability. However, translating these improvements into the field still faces the resonating challenges of reaching analytical proficiency (selectivity, sensitivity, robustness, stability), practical end-user functionality, minimal matrix interferences and cost effectiveness. Herein, we elaborate on these challenges via a critical evaluation of current studies and examine how realistic the prospects of on-site nitrate, nitrite and ammonium are. We also present recommendations in addressing these gaps to conclude the review. 相似文献
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Singh Swati Bawitlung Laldingngheti Singh Munmun Kumar Chauhan Amit Padalia Rajendra Chandra Pal Anirban Verma Ram Swaroop 《Chemistry of Natural Compounds》2022,58(1):161-162
Chemistry of Natural Compounds - 相似文献
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Kriti Pathak Sourav Gayen Suvam Saha Chandan Nandi Shivankan Mishra Prof. Dr. Sundargopal Ghosh 《Chemistry (Weinheim an der Bergstrasse, Germany)》2022,28(18):e202104393
Treatment of [Cp*RuCl2]2, 1 , [(COD)IrCl]2, 2 or [(p-cymene)RuCl2]2, 3 (Cp*=η5-C5Me5, COD= 1,5-cyclooctadiene and p-cymene=η6-iPrC6H4Me) with heterocyclic borate ligands [Na[(H3B)L], L1 and L2 ( L1 : L=amt, L2 : L=mp; amt=2-amino-5-mercapto-1,3,4-thiadiazole, mp=2-mercaptopyridine) led to the formation of borate complexes having uncommon coordination. For example, complexes 1 and 2 on reaction with L1 and L2 afforded dihydridoborate species [LAM(μ-H)2BHL] 4 – 6 ( 4 : LA=Cp*, M=Ru, L=amt; 5 : LA=Cp*, M=Ru, L=mp; 6 : LA=COD, M=Ir, L=mp). On the other hand, treatment of 3 with L2 yielded cis- and trans-bis(dihydridoborate) species, [Ru{(μ-H)2BH(mp)}2], cis- 7 and trans- 7 . The isolation and structural characterization of fac- and mer-[Ru{(μ-H)2BH(mp)}{(μ-H)BH(mp)2}], 8 from the same reaction offered an insight into the behaviour of these dihydridoborate species in solution. Fascinatingly, despite having reduced natural charges on Ru centres both at cis-and trans- 7 , they underwent hydroboration reaction with alkynes that yielded both Markovnikov and anti-Markovnikov addition products, 10 a – d . 相似文献
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Ambarish Mondal Rajat K. Tripathy Parul Dutta Manas Kumar Santra Anvarhusein A. Isab Christopher W. Bielawski Hemanta K. Kisan Swapan K. Chandra Joydev Dinda 《应用有机金属化学》2019,33(1)
The syntheses, structures, and chemotherapeutic activities of Ag(I)‐, Au(I)‐, and Ru(II)‐complexes ligated to a novel N‐heterocyclic carbene ligand, 2‐(4‐nitrophenyl)imidazo[1,5‐a]pyridin‐2‐ylidene ( 1 ), are described. The corresponding complexes, [Ag( 1 )2][PF6], [Au( 1 )2][PF6] ( 3 ), and [Ru( 1 )(p‐cymene)Cl][PF6] ( 4 ), were prepared using convenient transmetallation chemistry and characterized using a range of spectroscopic and analytical techniques. X‐ray crystallography revealed that complexes 2 and 3 adopted linear structures whereas 4 exhibited a prototypical “piano‐stool”‐like geometry; the structural assignments were further supported by DFT calculations. A series of in vitro studies revealed that while the aforementioned Ag(I), Au(I) and Ru(II) complexes exhibited significant cytotoxicities against the human colon adenocarcinoma (HCT 116), lung cancer (A549), and breast cancer (MCF7) cell lines, the Ru derivative was most prominent. 相似文献
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Vishal Kandathil Aisha Siddiqa Abhinandan Patra Bhakti Kulkarni Manjunatha Kempasiddaiah B.S. Sasidhar Shivaputra A. Patil Chandra Sekhar Rout Siddappa A. Patil 《应用有机金属化学》2020,34(11):e5924
N-heterocyclic carbene (NHC)-palladium(II) complex (GO@NHC-Pd) was synthesized on graphene oxide (GO) support via a simple and cost-effective multistep approach. The spectroscopic, microscopic, thermal, and surface analyses of GO@NHC-Pd confirmed the successful formation of the catalyst. The investigation of catalytic activity showed that GO@NHC-Pd was very effective in Suzuki–Miyaura as well as Hiyama cross-coupling. Being heterogeneous in nature, GO@NHC-Pd was recovered after each reaction cycle easily and reused for up to nine and six cycles in Suzuki–Miyaura and Hiyama cross-coupling, respectively, without significant loss of activity. Further exploration of the supercapacitor performance of GO@NHC-Pd catalyst assembled in a two-electrode cell configuration shown a maximum attained capacitance of 105.26 F/g at a current density of 0.1 A/g with good cycling stability of 96.89% over 2,500 cycles. 相似文献
8.
A sharp‐interface immersed boundary framework for simulations of high‐speed inviscid compressible flows 下载免费PDF全文
Shuvayan Brahmachary Ganesh Natarajan Vinayak Kulkarni Niranjan Sahoo 《国际流体数值方法杂志》2018,86(12):770-791
A new finite‐volume flow solver based on the hybrid Cartesian immersed boundary (IB) framework is developed for the solution of high‐speed inviscid compressible flows. The IB method adopts a sharp‐interface approach, wherein the boundary conditions are enforced on the body geometry itself. A key component of the present solver is a novel reconstruction approach, in conjunction with inverse distance weighting, to compute the solutions in the vicinity of the solid‐fluid interface. We show that proposed reconstruction leads to second‐order spatial accuracy while also ensuring that the discrete conservation errors diminish linearly with grid refinement. Investigations of supersonic and hypersonic inviscid flows over different geometries are carried out for an extensive validation of the proposed flow solver. Studies on cylinder lift‐off and shape optimisation in supersonic flows further demonstrate the efficacy of the flow solver for computations with moving and shape‐changing geometries. These studies conclusively highlight the capability of the proposed IB methodology as a promising alternative for robust and accurate computations of compressible fluid flows on nonconformal Cartesian meshes. 相似文献
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Nonlinear Dynamics - This paper extends the RGD model originally proposed by Richard et al. (J Sound Vib 305(3):432–456, 2007, https://doi.org/10.1016/j.jsv.2007.04.015) to investigate... 相似文献
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