全文获取类型
收费全文 | 572篇 |
免费 | 13篇 |
专业分类
化学 | 276篇 |
力学 | 14篇 |
数学 | 116篇 |
物理学 | 179篇 |
出版年
2022年 | 2篇 |
2021年 | 5篇 |
2020年 | 4篇 |
2019年 | 4篇 |
2018年 | 5篇 |
2017年 | 4篇 |
2016年 | 4篇 |
2015年 | 13篇 |
2014年 | 11篇 |
2013年 | 21篇 |
2012年 | 26篇 |
2011年 | 41篇 |
2010年 | 24篇 |
2009年 | 19篇 |
2008年 | 22篇 |
2007年 | 26篇 |
2006年 | 41篇 |
2005年 | 41篇 |
2004年 | 33篇 |
2003年 | 19篇 |
2002年 | 25篇 |
2001年 | 14篇 |
2000年 | 18篇 |
1999年 | 5篇 |
1998年 | 6篇 |
1997年 | 10篇 |
1996年 | 8篇 |
1995年 | 6篇 |
1994年 | 6篇 |
1993年 | 8篇 |
1992年 | 7篇 |
1991年 | 3篇 |
1990年 | 4篇 |
1989年 | 2篇 |
1987年 | 5篇 |
1985年 | 9篇 |
1984年 | 7篇 |
1982年 | 6篇 |
1981年 | 8篇 |
1980年 | 6篇 |
1979年 | 5篇 |
1978年 | 14篇 |
1977年 | 8篇 |
1976年 | 4篇 |
1975年 | 3篇 |
1974年 | 5篇 |
1973年 | 3篇 |
1972年 | 3篇 |
1970年 | 3篇 |
1968年 | 3篇 |
排序方式: 共有585条查询结果,搜索用时 31 毫秒
21.
Goujon F Malfreyt P Simon JM Boutin A Rousseau B Fuchs AH 《The Journal of chemical physics》2004,121(24):12559-12571
The Monte Carlo (MC) and molecular dynamics (MD) methodologies are now well established for computing equilibrium properties in homogeneous fluids. This is not yet the case for the direct simulation of two-phase systems, which exhibit nonuniformity of the density distribution across the interface. We have performed direct MC and MD simulations of the liquid-gas interface of n-pentane using a standard force-field model. We obtained density and pressure components profiles along the direction normal to the interface that can be very different, depending on the truncation and long range correction strategies. We discuss the influence on predicted properties of different potential truncation schemes implemented in both MC and MD simulations. We show that the MD and MC profiles can be made in agreement by using a Lennard-Jones potential truncated via a polynomial function that makes the first and second derivatives of the potential continuous at the cutoff distance. In this case however, the predicted thermodynamic properties (phase envelope, surface tension) deviate from experiments, because of the changes made in the potential. A further readjustment of the potential parameters is needed if one wants to use this method. We conclude that a straightforward use of bulk phase force fields in MD simulations may lead to some physical inconsistencies when computing interfacial properties. 相似文献
22.
Applied Biochemistry and Biotechnology - Although lignocellulosic biomass and wastes are targeted as an attractive alternative fermentation feedstock for the production of fuel ethanol, cellulosic... 相似文献
23.
A primary cleavage of aliphatic ozonides by electron-impact, implying O? O and C? C bond breaking, is described. This mode of degradation, which is not observed for aromatic ozonides, is fav oured by electron releasing substituents. For the cis and trans 4-methyl-2pentene ozonides, the ionization potentials are 8.81 and 8.86 (±0.5) eV, respectively. Two formation thresholds are observed for the [RCHO2]+ion which are interpreted in terms of different modes of ozonide cleavage. 相似文献
24.
The IDCP-promoted intramolecular C-glycosylation of pentenyl α-mannopyranosides carrying, at O-2, an activated benzyl group gave, unexpectedly, the 1,2-trans-fused bicyclic product which corresponds to an α-C-aryl mannopyranose derivative. This remarkable, strained C-glycosyl compound was rapidly epimerized to the more stable 1,2-cis product on treatment with BF3·Et2O. The IDCP-reaction product could be elaborated into a 2-(α-C-mannopyranosyl)-3,4,5-trimethoxybenzyl alcohol derivative. 相似文献
25.
Design and analysis of a Schwarz coupling method for a dimensionally heterogeneous problem 下载免费PDF全文
In the present work, we propose and analyse an efficient iterative coupling method for a dimensionally heterogeneous problem. We consider the case of a 2D Laplace equation with non‐symmetric boundary conditions coupled with a corresponding 1D Laplace equation. We first show how to obtain the 1D model from the 2D one by integration along one direction, by analogy with the link between shallow water equations and the Navier–Stokes system. Then we focus on the design of a Schwarz‐like iterative coupling method. We discuss the choice of boundary conditions at coupling interfaces. We prove the convergence of such algorithms and give some theoretical results related to the choice of the location of the coupling interface, and to the control of the difference between a global 2D reference solution and the 2D coupled solution. These theoretical results are illustrated numerically. Copyright © 2014 John Wiley & Sons, Ltd. 相似文献
26.
Mehrdad Nikravech Kamal Baba Bernard Leneindre Frédéric Rousseau 《Chemical Papers》2012,66(5):502-510
Processing the aerosol of metal salts in non-equilibrium plasma represents a promising technique that combines the advantages
of spray pyrolysis with the high reactivity of plasmas at nearlaboratory temperature in order to produce mixed-oxides and
perovskite materials. The aim of this paper is to describe the principles of this new technique and to present the various
applications and latest developments. This technique’s capacity to deposit various mixed metal oxides with precise stoichiometry
is demonstrated. It is shown that oxidant plasma species play a key role in the chemical transformation of starting materials
into oxides at laboratory temperature, while the configuration of the reactor determines the morphology and texture of the
deposited layers. Two different reactor configurations are presented. The porous layers of La
x
Sr1−x
MnO3 as the cathode for fuel cells were synthesised in a wave shock reactor configuration, while nanostructured ZnO-Al layers
to form a transparent conductive cathode for photovoltaic cells were deposited in the spray plasma reactor of the latest generation
for this technique. The experimental results emphasise the role of plasma species in the rate of chemical reactions and in
the chemical composition of the deposited layers. 相似文献
27.
Nadia Lahrichi Teodor Gabriel Crainic Michel Gendreau Walter Rei Louis-Martin Rousseau 《The Journal of the Operational Research Society》2015,66(1):44-56
The dairy transportation problem (DTP) consists of determining the best routes to be performed for collecting milk from farms and delivering it to processing plants. We study the particular case of the province of Quebec, where the Fédération des producteurs de lait du Québec is responsible for negotiating the transportation costs on behalf of producers. Several issues are highlighted in the actual process of designing contracts such as using historical data. We propose an approach based on scenario analysis that consists of revising both the steps and the information used to construct the routes. We develop a generalized tabu search algorithm that integrates the different characteristics of the DTP. 相似文献
28.
29.
Sylvain Maclot Michael Capron Rémi Maisonny Arkadiusz Ławicki Dr. Alain Méry Dr. Jimmy Rangama Prof. Dr. Jean‐Yves Chesnel Sadia Bari Prof. Dr. Ronnie Hoekstra Dr. Thomas Schlathölter Prof. Dr. Bruno Manil Prof. Dr. Lamri Adoui Dr. Patrick Rousseau Prof. Dr. Bernd A. Huber 《Chemphyschem》2011,12(5):881-881
30.
Dr. Antoine Leliège M. Sc. Jérémie Grolleau M. Sc. Magali Allain Dr. Philippe Blanchard Dr. Dora Demeter Dr. Théodulf Rousseau Dr. Jean Roncali 《Chemistry (Weinheim an der Bergstrasse, Germany)》2013,19(30):9948-9960
Donor–acceptor (D–π–A) systems that combine triarylamine donor blocks and dicyanovinyl (DCV) acceptor groups have been synthesized. Starting from the triphenylamine (TPA)? thiophene? DCV compound ( 1 ) as a reference system, various synthetic approaches have been developed for controlling the light‐harvesting properties and energy levels of the frontier orbitals in this molecule. Thus, the introduction of methoxy groups onto TPA, the replacement of one phenyl ring of TPA by a thiophene ring, or the extension of the π‐conjugating spacer group lead to the modulation of the HOMO level. On the other hand, the fusion of the DCV group onto the vicinal thiophene ring by an ortho‐phenylene bridge allows for a specific fine‐tuning of the LUMO level. The electronic properties of the molecules were analyzed by using UV/Vis spectroscopy and cyclic voltammetry and the compounds were evaluated as donor materials in basic bilayer planar heterojunction solar cells by using C60 as acceptor material. The relationships between the electronic properties of the donors and the performance of the corresponding photovoltaic devices are discussed. Bilayer planar heterojunction solar cells that used reference compound 1 and C70 afforded power‐conversion efficiencies of up to 3.7 %. 相似文献