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101.
Singh Ajit Shankar Shukla S. K. Mishra Preeti Pandey A. K. 《Journal of Thermal Analysis and Calorimetry》2022,147(12):6665-6677
Journal of Thermal Analysis and Calorimetry - Phthalonitrile (PN) resins are high-temperature-resistant thermosetting polymers which find applications in military as well as aerospace owing to... 相似文献
102.
Marija R. Zoric Usha Pandey Kadel Kirill A. Korvinson Hoi Ling Luk Arunpatcha Nimthong‐Roldan Matthias Zeller Ksenija D. Glusac 《Journal of Physical Organic Chemistry》2016,29(10):505-513
The conformational flexibility of three covalently linked dimers consisting of two xanthene‐based moieties connected by a diphenyl ether linker was studied using NMR spectroscopy, X‐ray crystallography, and density functional theory (DFT) calculations. The three dimers interconvert as a function of pH: the doubly cationic dimer (Xan+)2 exists in acidic solutions (pH < 0.5), the mono‐alcohol monocation Xan+–Xan‐OH at intermediate pH values (pH = 1–3), and the neutral diol at the highest pH‐values (pH > 3). Each dimer exhibits conformational degrees of freedom associated with rotations of either the xanthene moiety or of the diphenyl ether (DPE) linker. The barriers for rotation of the xanthylium moiety were evaluated using DFT calculations, yielding values of 23 kcal/mol for (Xan+)2 and 11 kcal/mol for (Xan‐OH)2, respectively. The rotational barrier for the diphenyl ether linker in Xan+–Xan‐OH (15 kcal/mol) was experimentally determined using variable temperature NMR measurements. The relative orientation of the two –OH groups in (Xan‐OH)2 diol was investigated in solution and the solid state using NMR spectroscopy and X‐ray crystallography. The conformer observed in the solid state was found to be the In–Out conformer, while free rotation of the xanthenol units is thought to occur on the NMR timescale at room temperature. These studies are relevant for the design of linkers for efficient water oxidation catalysts. Copyright © 2016 John Wiley & Sons, Ltd. 相似文献
103.
Balasubramonian S. Pandey N. K. Shekhar Kumar Subba Rao R. V. 《Journal of solution chemistry》2021,50(11-12):1300-1314
Journal of Solution Chemistry - The speciation of nitric acid was modeled using eUNIQUAC activity coefficient model and the thermodynamic dissociation constant was estimated by solving the... 相似文献
104.
Pandey Shwetank Shashi Barwa Manjeet Singh Gautam Yogendra Prakash Markandeya Pani Balaram 《Journal of Radioanalytical and Nuclear Chemistry》2021,329(1):35-43
Journal of Radioanalytical and Nuclear Chemistry - GIS based groundwater uranium and other physico-chemical parameters pH, electrical conductivity, oxidation reduction potential, temperature,... 相似文献
105.
106.
Vesicle Structures from Bolaamphiphilic Biosurfactants: Experimental and Molecular Dynamics Simulation Studies on the Effect of Unsaturation on Sophorolipid Self‐Assemblies 下载免费PDF全文
Prabhu Dhasaiyan Prithvi Raj Pandey Nikunjkumar Visaveliya Dr. Sudip Roy Dr. B. L. V. Prasad 《Chemistry (Weinheim an der Bergstrasse, Germany)》2014,20(21):6246-6250
The formation of giant‐vesicle‐like structures by self‐assembling linolenic acid sophorolipid (LNSL) molecules is revealed. Sophorolipids belong to the class of bolaamphiphilic glycolipid biosurfactants. Interestingly, the number of double bonds present in the hydrophobic core of sophorolipids is seen to have a great influence on the type of self‐assembled structures formed. Dye encapsulation results establish the presence of an aqueous compartment inside the LNSL vesicles. Molecular dynamics simulation (MD) studies suggest the existence of two possible conformations of LNSLs inside the self‐assembled structures and that LNSL molecules arrange in layered structures. 相似文献
107.
Augustine Elizabeth Desigan N. Pandey N. K. Joshi J. B. 《Journal of Radioanalytical and Nuclear Chemistry》2020,324(1):211-218
Journal of Radioanalytical and Nuclear Chemistry - In the present study, the dissolution kinetics of UO2 pellets in nitric acid has been investigated. Kinetic rate expressions based on... 相似文献
108.
Sharma Deepika Radha Anu Kumar Pretam Kumar Sandeep Jassal Amanpreet K. Lata Suman Vikas Pandey Sushil K. 《Transition Metal Chemistry》2020,45(8):531-544
Transition Metal Chemistry - Nickel(II) complexes with octahedral coordination stabilized by N-donor ligands corresponds to [{(ArO)2PS2}2Ni·L2] [Ar = 4-(C2H5)C6H4 (3), and... 相似文献
109.
Dr. Abshar Hasan Dr. Kyueui Lee Dr. Kunal Tewari Prof. Lalit M. Pandey Prof. Phillip B. Messersmith Prof. Karen Faulds Dr. Michelle Maclean Dr. King Hang Aaron Lau 《Chemistry (Weinheim an der Bergstrasse, Germany)》2020,26(26):5789-5793
Microbial surface attachment negatively impacts a wide range of devices from water purification membranes to biomedical implants. Mimics of antimicrobial peptides (AMPs) constituted from poly(N-substituted glycine) „peptoids“ are of great interest as they resist proteolysis and can inhibit a wide spectrum of microbes. We investigate how terminal modification of a peptoid AMP-mimic and its surface immobilization affect antimicrobial activity. We also demonstrate a convenient surface modification strategy for enabling alkyne–azide „click“ coupling on amino-functionalized surfaces. Our results verified that the N- and C-terminal peptoid structures are not required for antimicrobial activity. Moreover, our peptoid immobilization density and choice of PEG tether resulted in a „volumetric“ spatial separation between AMPs that, compared to past studies, enabled the highest AMP surface activity relative to bacterial attachment. Our analysis suggests the importance of spatial flexibility for membrane activity and that AMP separation may be a controlling parameter for optimizing surface anti-biofouling. 相似文献
110.
Alam Noor Sharma K. K. Pandey K. M. 《Journal of Thermal Analysis and Calorimetry》2020,140(5):2485-2495
Journal of Thermal Analysis and Calorimetry - The objective of present research work is to investigate the combustion flame acceleration and performance of pulse detonation engine (PDE). The PDE... 相似文献