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991.
Sreenivasulu M Kumar KS Kumar PR Chandrasekhar KB Pal M 《Organic & biomolecular chemistry》2012,10(8):1670-1679
A dually NHC-catalyzed reaction cascade comprising an initial hydroacylation of an activated ketone and subsequent Sonogashira/Heck/Suzuki coupling in the same pot is reported. The reaction mechanism and scope of the methodology is presented. 相似文献
992.
New dimethyldi(2-pyridyl)borato (dmdpb) platinum(II) complexes, (dmdpb)Pt(II)Me(SMe(2)) (1), (dmdpb)Pt(II)(L)(SMe(2))(+), L = MeOH (2), MeCN (3), supported by dimethylsulfide ligand and featuring one (1) or no hydrocarbyls at the metal (2, 3) were prepared and their oxidation with hydrogen peroxide was studied. Both complex 1 bearing the formal charge of +1 on the metal and the methanol complex 2 capable of losing the proton of the methanol ligand to form the methoxide derivative 4 charged similarly to 1, are reactive towards H(2)O(2). However, the cationic complex 3 with a formal charge of +2 on the metal does not react with H(2)O(2). The oxidation of the monomethyl platinum(II) complex 1 leads to the B-to-Pt methyl transfer and formation of a robust dimethyl Pt(IV) species 5 which does not undergo C-O reductive elimination up to 100 °C. By contrast, oxidation of 2 in methanol-d(4) leads to quantitative formation of dimethyl ether-d(3), CD(3)OCH(3). It was presumed that the latter reaction involves the B-to-Pt methyl transfer and formation of a highly reactive cationic monomethyl Pt(IV) species whose methyl group carbon atom can accept nucleophilic attack by the methanol-d(4) solvent to form dimethyl ether-d(3). 相似文献
993.
Gurinder Pal SinghSimranpreet Kaur Parvinder KaurD.P. Singh 《Physica B: Condensed Matter》2012,407(8):1250-1255
The structural and optical analysis of glasses is carried out by XRD, FTIR, density and UV visible spectroscopic measurement techniques. XRD results have confirmed the glassy nature of the samples. The FTIR spectral analysis reveals that with the combined presence of ZnO and CeO2 contents in Al2O3-PbO-B2O3 glasses, more BO3 groups are transformed into BO4. The optical analysis reveals that optical band gap energy decreases more for CeO2-ZnO-Al2O3-PbO-B2O3 glasses (from 2.28 to 1.84 eV). The presence of CeO2 and ZnO in the glass samples causes more compaction of the borate network due to the formation of more BO4 groups and the presence of ZnO4 groups, which results an increase in density, refractive index and decrease of molar volume. 相似文献
994.
Gurinder Pal Singh Parvinder KaurSimranpreet Kaur D.P. Singh 《Physica B: Condensed Matter》2012,407(21):4168-4172
xCeO2–30Bi2O3–(70−x) B2O3 glasses are synthesized by using the melt quench technique. A number of studies such as XRD, density, molar volume, optical band gap, refractive index and FTIR spectroscopy are employed to characterize the glasses. The band gap decreases from 2.15 to 1.61 eV, refractive index increases from 2.67 to 2.93 and density increases from 4.151 to 4.633 g/cm3. The decrease in band gap with CeO2 doping approaches the semiconductor behavior. FTIR spectroscopy reveals that incorporation of CeO2 into glass network helps to convert the structural units of [BO3] into [BO4] and results in Bi–O bond vibration of [BiO6]. 相似文献
995.
Surajit Ghosh Tanusri Pal Daeha Joung Saiful I. Khondaker 《Applied Physics A: Materials Science & Processing》2012,107(4):995-1001
We report the synthesis and characterization of lead sulfide (PbS) decorated reduced graphene oxide (RGO) nanocomposite materials. The materials were synthesized in a one-step solvothermal reaction where the reduction of graphene oxide, synthesis of PbS nanoparticle and decoration of PbS onto RGO were done simultaneously. Structural characterizations reveal that PbS nanoparticles are highly crystalline and a strong interaction exists between RGO and PbS. We also demonstrate fabrication of a near infrared (NIR) photo detector using RGO/PbS nanocomposite film. 相似文献
996.
The cis- and trans-azobenzenes are known as photochromic isomers with the trans- converting into the cis-form and vice versa upon irradiation with specific wavelengths. We have quantum chemically investigated the cis- and trans-forms of substituted azobenzene diradicals, with two nitronyl nitroxides, imino nitoxides, or verdazyls at para positions and serving as monoradical centers, to determine whether they can exhibit a photoassisted magnetic crossover. Geometries of both substituted and unsubstituted molecules have been optimized by density functional (DF) method UB3LYP using the 6-311G(d,p) basis set. Optimization of the geometry of the cis isomers has required special care. Single point singlet, triplet, and broken symmetry calculations have been done using 6-311++G(3df, 3pd) basis set. The magnetic exchange coupling constants have been estimated from the broken symmetry calculations. Absorption wavelengths have been estimated for both substituted and unsubstituted species from time-dependent DF treatment using restricted spin-polarized methodology RB3LYP and 6-311++G(3df, 3pd) basis set. From the similarity in the calculated absorption wavelengths for the unsubstituted and substituted azobenzenes, and the increased oscillator strengths (f) for the substituted species, we predict that the diradical isomers would be strongly photochromic. From our triplet state and broken symmetry calculations, we predict that both the cis- and the trans-diradicals are antiferromagnetically coupled. This prediction is consistent with the spin alternation rule, and the possibility of a magnetic crossover is nonexistent for these species. 相似文献
997.
Santoni MP Pal AK Hanan GS Tang MC Venne K Furtos A Ménard-Tremblay P Malveau C Hasenknopf B 《Chemical communications (Cambridge, England)》2012,48(2):200-202
Pd(II)-directed self-assembly of a 3-pyridyl grafted Lindqvist hexavanadate led to the formation of a unique trimeric species, as confirmed by a variety of techniques, including pulsed-field gradient NMR spectroscopy and high-resolution ESI mass spectrometry. 相似文献
998.
During the last few decades several logic gates, sequential and combinational logic devices, have been developed using light signals. For this work several encoding as well as decoding techniques are proposed for data handling and information processing with optics as information carrying signal. Frequency encoding technique is one such type of encoding processes, which gives a very good response for long distance communication of logically processed data because frequency is a fundamental character of light and it remains unchanged for long distance communication. Here in this paper the authors propose a frequency encoded multiplexer with the proper use of semiconductor optical amplifier in tri-state logic. 相似文献
999.
The self-assembly of non-toxic well-consumed small caffeine molecules into well-defined structures has important implications
for future medical applications seeking to target the transport of small drugs in human body. Particularly, the solvation
of the microenvironments of the self assembly ultimately dictates the interaction with the drug molecules and their therapeutic
efficacy. We present femtosecond-resolved studies of the dynamics of aqueous solvation within self-assembled dimeric structure
of caffeine molecules. We have placed small hydrophobic probes 4-(dicyanomethylene)-2-methyl-6-(p-dimethylaminostyryl) 4H-pyran
(DCM), coumarin 500 (C500) into the caffeine dimer to enable spectroscopic examinations of the interior. While molecular modeling
and NMR studies of the probes in the caffeine dimers reveal a well-defined location (stacked in between two caffeine molecules),
dynamical light scattering (DLS), Fourier transform infrared (FTIR) spectroscopy, densimetric and sonometric experiments explore
the structural evolution of the dimer upon complexation with the probes. We have extended our studies in various temperatures
in order to explore structural evolution of the self assembled structure and consequently the dynamics of solvation in the
interior of the dimer. Picoseconds/femtosecond resolved dynamics and the polarization gated spectroscopic studies unravel
the hydration and energetics associated with activated viscous flow of the confined probes. Our studies indicate that the
interior of the caffeine dimer is well-solvated; however, the dynamics of solvation is retarted significantly compared to
that in bulk water, clearly revealing the dimers maintain some ordered water molecules. We have also explored the consequence
of the retarded dynamics of solvation on the photo-induced electron transfer (ET) reaction of a model probe, 2-(p-toluidino)
naphthalene-6-sulfonate (TNS) encapsulated in the dimer. 相似文献
1000.
V. P. Popov L. N. Safronov O. V. Naumova V. A. Volodin I. N. Kupriyanov Yu. N. Pal’yanov 《Bulletin of the Russian Academy of Sciences: Physics》2012,76(5):577-581
(111) synthetic HPTP diamond plates are irradiated by H 2 + 50 keV ions in the range of the fluences of 1?13 × 1016 sm?2 and annealed in vacuum at 1 mPa (VPHT, 500?C1600°C) or at high HPHT parameters (4.0?C7.5 GPa, 1200?C1550°C). It is shown by measuring the layer conductivity and Raman light scattering that after VPHT annealing, a buried layer of glassy carbon 10?C100 nm thick with low resistance (??1 kOhm/??) is formed, followed by HPHT with high resistance (??1 MOhm/??) and hopping transport along defects. 相似文献