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151.
Jo E Jhon YH Choi SB Shim JG Kim JH Lee JH Lee IY Jang KR Kim J 《Chemical communications (Cambridge, England)》2010,46(48):9158-9160
A crystal structure of a carbamate of 2-amino-2-methyl-1-propanol (AMP-carbamate) has been elucidated and its structural and electronic properties investigated by density functional theory calculations and natural bond orbital analyses. 相似文献
152.
Chang Yeon Lee Dr. Jae Kwon Jang Chul Hoon Kim Dr. Jaehoon Jung Bo Keun Park Dr. Jihee Park Wonyong Choi Prof. Young‐Kyu Han Dr. Taiha Joo Prof. Joon T. Park Prof. 《Chemistry (Weinheim an der Bergstrasse, Germany)》2010,16(19):5586-5599
A new artificial photosynthetic triad array, a [60]fullerene–triosmium cluster/zinc–porphyrin/boron–dipyrrin complex ( 1 , Os3C60/ZnP/Bodipy), has been prepared by decarbonylation of Os3(CO)8(CN(CH2)3Si(OEt)3)(μ3‐η2:η2:η2‐C60) ( 6 ) with Me3NO/MeCN and subsequent reaction with the isocyanide ligand CNZnP/Bodipy ( 5 ) containing zinc porphyrin (ZnP) and boron dipyrrin (Bodipy) moieties. Triad 1 has been characterized by various spectroscopic methods (MS, NMR, IR, UV/Vis, photoluminescence, and transient absorption spectroscopy). The electrochemical properties of 1 in chlorobenzene (CB) have been examined by cyclic voltammetry; the general feature of the cyclic voltammogram of 1 is nine reversible one‐electron redox couples, that is, the sum of those of 5 and 6 . DFT has been applied to study the molecular and electronic structures of 1 . On the basis of fluorescence‐lifetime measurements and transient absorption spectroscopic data, 1 undergoes an efficient energy transfer from Bodipy to ZnP and a fast electron transfer from ZnP to C60; the detailed kinetics involved in both events have been elucidated. The SAM of triad 1 ( 1 /ITO; ITO=indium–tin oxide) has been prepared by immersion of an ITO electrode in a CB solution of 1 and diazabicyclo‐octane (2:1 equiv), and characterized by UV/Vis absorption spectroscopy, water contact angle, X‐ray photoelectron spectroscopy, and cyclic voltammetry. The photoelectrochemical properties of 1 /ITO have been investigated by a standard three‐electrode system in the presence of an ascorbic acid sacrificial electron donor. The quantum yield of the photoelectrochemical cell has been estimated to be 29 % based on the number of photons absorbed by the chromophores. Our triad 1 is unique when compared to previously reported photoinduced electron‐transfer arrays, in that C60 is linked by π bonding with little perturbation of the C60 electron delocalization. 相似文献
153.
Park J Lee G Wolff-Fabris F Koh YY Eom MJ Kim YK Farhan MA Jo YJ Kim C Shim JH Kim JS 《Physical review letters》2011,107(12):126402
We report the observation of highly anisotropic Dirac fermions in a Bi square net of SrMnBi(2), based on a first-principles calculation, angle-resolved photoemission spectroscopy, and quantum oscillations for high-quality single crystals. We found that the Dirac dispersion is generally induced in the (SrBi)(+) layer containing a double-sized Bi square net. In contrast to the commonly observed isotropic Dirac cone, the Dirac cone in SrMnBi(2) is highly anisotropic with a large momentum-dependent disparity of Fermi velocities of ~8. These findings demonstrate that a Bi square net, a common building block of various layered pnictides, provides a new platform that hosts highly anisotropic Dirac fermions. 相似文献
154.
In Hwan Jung Hoyeon Kim Moo‐Jin Park Bongjun Kim Jong‐Hwa Park Eunjae Jeong Han Young Woo Seunghyup Yoo Hong‐Ku Shim 《Journal of polymer science. Part A, Polymer chemistry》2010,48(6):1423-1432
We have synthesized two cyclopentadithiophene (CDT)‐based low bandgap copolymers, poly[(4,4‐bis(2‐ethyl‐hexyl)‐4H‐cyclopenta[2,1‐b:3,4‐b′]dithiophene‐2,6‐diyl)‐alt‐(benzo[c][1,2,5]selenadiazole‐4,7‐diyl)] (PCBSe) and poly[(4,4‐bis(2‐ethyl‐hexyl)‐4H‐cyclopenta[2,1‐b:3,4‐b′]dithiophene‐2,6‐diyl)‐alt‐(4,7‐dithiophen‐2‐yl‐benzo[c][1,2,5]selenadiazole‐5,5′‐diyl)] (PCT2BSe), for use in photovoltaic applications. Through the internal charge transfer interaction between the electron‐donating CDT unit and the electron‐accepting benzoselenadiazole, we realized exceedingly low bandgap polymers with bandgaps of 1.37–1.46 eV. The UV–vis absorption maxima of PCT2BSe were subjected to larger hypsochromic shifts than those of PCBSe, because of the distorted electron donor–acceptor (D–A) structures of the PCT2BSe backbone. These results were supported by the calculations of the D–A complex using the ab initio Hartree‐Fock method with a split‐valence 6‐31G* basis set. However, PCT2BSe exhibited a better molar absorption coefficient in the visible region, which can lead to more efficient absorption of sunlight. As a result, PCT2BSe blended with [6,6]‐phenyl‐C61‐butyric acid methyl ester (PC61BM) exhibited a better photovoltaic performance than PCBSe because of the larger spectral overlap integral with respect to the solar spectrum. Furthermore, when the polymers were blended with PC71BM, PCT2BSe showed the best performance, with an open circuit voltage of 0.55 V, a short‐circuit current of 6.63 mA/cm2, and a power conversion efficiency of 1.34% under air mass 1.5 global illumination conditions. © 2010 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 48: 1423–1432, 2010 相似文献
155.
Junhan Cho Min Su Park Jin Hyun Choi Byung Chul Ji Sung Soo Han Won Seok Lyoo 《Journal of Polymer Science.Polymer Physics》2001,39(15):1778-1783
A novel blend system was prepared by blending organosoluble nitro‐substituted polybenzimidazole (NO2‐PBI) and polyetherimide (PEI) in a cosolvent at a moderate condition. It was shown that the NO2‐PBI/PEI blends not only possess tractable processability owing to the enhanced solubility of NO2‐PBI but also retain the desirable features of unmodified PBI/PEI blends. Apparent miscibility in the blends was observed and attributed to hydrogen‐bonding interactions between N? H groups in NO2‐PBI and carbonyl groups in PEI. It was revealed that the NO2‐PBI/PEI blends phase‐separate upon heating above the glass‐transition temperatures. The observed mixing of NO2‐PBI and PEI in a molecular level, although sustainable only in the glassy region, was shown to lend synergy effects to the physical properties of the blends. © 2001 John Wiley & Sons, Inc. J Polym Sci Part B: Polym Phys 39: 1778–1783, 2001 相似文献
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157.
We study the validity of the Born–Oppenheimer approximation in chaotic dynamics. Using numerical solutions of autonomous Fermi accelerators, we show that the general adiabatic conditions can be interpreted as the narrowness of the chaotic region in phase space. 相似文献
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160.
Choi Hyunkyung Seo Jae Yeon Kim Chul Sung 《Journal of Radioanalytical and Nuclear Chemistry》2021,330(2):461-467
Journal of Radioanalytical and Nuclear Chemistry - The 57Fe doped LiMnPO4 cathode with potential applications in Li-ion batteries was prepared by solid-state reaction. The magnetic susceptibility... 相似文献