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31.
Gayatri Kumari N. R. Patil Venkata Srinu Bhadram Ritesh Haldar Satyanarayana Bonakala Tapas Kumar Maji Chandrabhas Narayana 《Journal of Raman spectroscopy : JRS》2016,47(2):149-155
Interpenetrating metal organic frameworks are interesting functional materials exhibiting exceptional framework properties. Uptake or exclusion of guest molecules can induce sliding in the framework making it porous or non‐porous. To understand this dynamic nature and how framework interaction changes during sliding, metal organic framework (MOF) 508 {Zn(BDC)( 4,4′‐Bipy)0.5 · DMF(H2O)0.5} was selected for study. We have investigated structural transformation in MOF‐508 under variable conditions of temperature, pressure and gas loading using Raman spectroscopy and substantiated it with IR studies and density functional theory (DFT) calculations. Conformational changes in the organic linkers leading to the sliding of the framework result in changes in Raman spectra. These changes in the organic linkers are measured as a function of high pressure and low temperature, suggesting that the dynamism in MOF‐508 framework is driven by ligand conformation change and inter‐linker interactions. The presence of Raman signatures of adsorbed CO2 and its librational mode at 149 cm−1 suggests cooperative adsorption of CO2 in the MOF‐508 framework, which is also confirmed from DFT calculations that give a binding energy of 34 kJ/mol. Copyright © 2015 John Wiley & Sons, Ltd. 相似文献
32.
Sanchita Mondal Saikat Kumar Manna Kalipada Maiti Rajkishor Maji Syed Samim Ali Srimanta Manna 《Supramolecular chemistry》2017,29(8):616-626
A FRET-based chemosensor L containing donor phenanthroline and acceptor fluorescein moiety was designed, synthesised and characterised for the ratiometric fluorescent detection of Cu2+ in organo-aqueous solution. Probe L showed high selectivity and excellent sensitivity towards Cu2+ ions by exhibiting both colorimetric and fluorometric changes due to opening of the spirolactum ring of fluorescein upon complexation with Cu2+. In presence of Cu2+ ions, probe L formed L-Cu2+ complex in 1:1 stoichiometric fashion which is established on the basis of Job’s plot and mass spectroscopy. We also performed DFT computational studies to know the binding nature and coordination feature of the complex. Furthermore, fluorescence imaging studies revealed that probe L was cell permeable and could be used to detect intracellular Cu2+ in living cells. 相似文献
33.
The reaction of VOSO(4) with 2-carboxyethylphosphonic acid (H(2)-CEP) in presence of piperazine (PIP) produces a 3D inorganic-organic hybrid framework, {(H(2)PIP)(0.5)[VO(CEP)]·H(2)O} (1) with bidirectional channels occupied by the H(2)PIP cations and H(2)O molecules. The PO(3)(2-) unit of CEP connects three V(IV) centers to generate a 1D ladder, which is further linked to four such ladders by the CEP linkers to form a 3D hybrid framework. The dehydrated framework, {(H(2)PIP)(0.5)[VO(CEP)]} (1') shows selective and gated adsorption behavior with H(2)O but not with methanol and ethanol. Very interestingly, when 1 is treated with an aqueous solution of LiNO(3)/NaNO(3), the framework breaks down and results in a new polyoxovanadate (POV) cluster, [H(5)(H(2)PIP)(3)][V(V)(12)V(IV)(2)O(38)(PO(4))]·8H(2)O (2) at pH ≈ 2.1. The cluster has been characterized by single-crystal X-ray diffraction, (31)P NMR, EPR, and magnetic studies. The temperature-dependent magnetic susceptibility measurement suggests antiferromagnetic ordering in 1 with T(N) ≈ 3.8 K. 相似文献
34.
An unexpected N-heterocyclic carbene-catalyzed esterification of α,β-unsaturated aldehydes including aromatic aldehydes with reactive cinnamyl bromides in the presence of air oxygen or MnO(2) as an oxidant is described. In the presence of oxygen, halogenated and electron-deficient aldehydes react smoothly to furnish esters in good yields. Great efforts have been made on mechanistic studies to deduce a plausible mechanism, based on the experimental results and isotopic labeling experiment. 相似文献
35.
A bimetallic pillared-layer coordination framework {[Mn(3)(bipy)(3)(H(2)O)(4)][Cr(CN)(6)](2)·2(bipy)·4(H(2)O)}(n) has been constructed using a cyanometallate anion ([Cr(CN)(6)](3-)) and an organic linker (4,4'-bipyridyl) that provides high heat of hydrogen adsorption (~11.5 kJ mol(-1)) and shows guest dependent magnetic modulation. 相似文献
36.
Isidoro Lpez Mehmed Z. Ertem Somnath Maji Jordi Benet‐Buchholz Anke Keidel Uwe Kuhlmann Peter Hildebrandt Christopher J. Cramer Victor S. Batista Antoni Llobet 《Angewandte Chemie (Weinheim an der Bergstrasse, Germany)》2014,126(1):209-213
The homogeneous catalysis of water oxidation by transition‐metal complexes has experienced spectacular development over the last five years. Practical energy‐conversion schemes, however, require robust catalysts with large turnover frequencies. Herein we introduce a new oxidatively rugged and powerful dinuclear water‐oxidation catalyst that is generated by self‐assembly from a mononuclear catalyst during the catalytic process. Our kinetic and DFT computational analysis shows that two interconnected catalytic cycles coexist while the mononuclear system is slowly and irreversibly converted into the more stable dinuclear system: an extremely robust water‐oxidation catalyst that does not decompose over extended periods of time. 相似文献
37.
Amine‐Responsive Adaptable Nanospaces: Fluorescent Porous Coordination Polymer for Molecular Recognition 下载免费PDF全文
Ritesh Haldar Prof. Ryotaro Matsuda Prof. Susumu Kitagawa Prof. Subi J. George Prof. Tapas Kumar Maji 《Angewandte Chemie (International ed. in English)》2014,53(44):11772-11777
Flexible and dynamic porous coordination polymers (PCPs) with well‐defined nanospaces composed of chromophoric organic linkers provide a scaffold for encapsulation of versatile guest molecules through noncovalent interactions. PCPs thus provide a potential platform for molecular recognition. Herein, we report a flexible 3D supramolecular framework {[Zn(ndc)(o‐phen)]?DMF}n (o‐phen=1,10‐phenanthroline, ndc=2,6‐napthalenedicarboxylate) with confined nanospaces that can accommodate different electron‐donating aromatic amine guests with selective turn‐on emission signaling. This system serves as a molecular recognition platform through an emission‐readout process. Such unprecedented tunable emission with different amines is attributed to its emissive charge‐transfer (CT) complexation with o‐phen linkers. In certain cases this CT emission is further amplified by energy transfer from the chromophoric linker unit ndc, as evidenced by single‐crystal X‐ray structural characterization. 相似文献
38.
Carbon fiber-reinforced plastic (CFRP) reinforced concrete beams can fail due to interface debonding, due to the high tensile
strength of such rebars. A set of 16 concrete beams reinforced with different amounts of CFRP reinforcement was subject to
static three-point bending. The beam dimensions and CFRP reinforcements used were selected to demonstrate a transition from
compression failure to bond failure with decreasing reinforcement ratio. It is shown that accurate bond strength data to predict
such failures can be obtained from a “hinged-beam” test configuration, rather than the conventional direct “pull-out” tests.
Deflection under service loads can also be predicted more accurately using a proposed equation that includes the reinforcement
ratio and the elastic modulus of the reinforcement. 相似文献
39.
Dipankar Mishra Subhendu Naskar Shyamal K. Chattopadhyay Milan Maji Parbati Sengupta Rupam Dinda Saktiprasad Ghosh Thomas C. W. Mak 《Transition Metal Chemistry》2005,30(3):352-356
The synthesis, crystal structure, redox and spectroscopic properties of trans-[Ru(bbpH2)(PPh3)2Cl]Cl are reported. In the crystalline solvate trans-[Ru(bbpH2)(PPh3)2cCl]Cl CHCl3 H2O, the molecular components are connected by strong intermolecular hydrogen bonding to form an infinite double column. 相似文献
40.
The deduction of the so well-renowned and established Laws of Kirchhoff relating to the currents flowing in a network, which are considered to be almost axiomatic in electrical engineering sciences, seems to be preposterous and non-sensical at first sight. However, on a closer examination it will appear that these laws are based on two principles, viz, the steady-state condition under which accumulation of free electrical charge is precluded, and, the experimentalOhm's Law, which propounds a linear relation between the difference of potential across a conductor and the total current flowing through the same. But, there are two things, which are normally overlooked. The conductors inKirchhoff's Laws are “wires”, which are one-dimensional lines, and theOhm's Law is the macroscopicOhm's Law for total currents applied to these lumped resistors. Strictly speaking, the “Laws” are to be deduced from the more fundamental electromagnetic equations for continuous media and the microscopicOhm's Law. It is to be noted that theKirchhoff Nodal Law is but a consequence of the steady state condition derivable from these basic equations, viz, the current-density is divergence-free. For a continuous medium, what the form of theKirchhoff's Laws will be, is difficult to guess unless deduced from the basic equations. Once these are established from the basic equations of electromagnetism for a continuous medium, the usual form ofKirchhoff's Laws will follow as corollary of the general case, as has been shown here. 相似文献