全文获取类型
收费全文 | 149篇 |
免费 | 4篇 |
专业分类
化学 | 103篇 |
晶体学 | 1篇 |
力学 | 2篇 |
数学 | 21篇 |
物理学 | 26篇 |
出版年
2022年 | 3篇 |
2021年 | 1篇 |
2020年 | 2篇 |
2019年 | 3篇 |
2018年 | 2篇 |
2017年 | 1篇 |
2016年 | 4篇 |
2015年 | 5篇 |
2014年 | 5篇 |
2013年 | 13篇 |
2012年 | 15篇 |
2011年 | 12篇 |
2010年 | 9篇 |
2009年 | 7篇 |
2008年 | 11篇 |
2007年 | 16篇 |
2006年 | 7篇 |
2005年 | 6篇 |
2004年 | 9篇 |
2003年 | 6篇 |
2002年 | 8篇 |
2000年 | 1篇 |
1997年 | 1篇 |
1981年 | 2篇 |
1980年 | 1篇 |
1978年 | 1篇 |
1974年 | 1篇 |
1973年 | 1篇 |
排序方式: 共有153条查询结果,搜索用时 15 毫秒
11.
Dominique Delbourg Gérard Penillault Tran Khan Tuong Martial Decourt Nicole Borome Henri Harroch Bertrand Lessellier Bernard Waast Jean Pierre Mouffron 《Pramana》2002,59(6):1025-1033
A new control system was designed for the tandem MP-9 at Orsay. Because of the existing devices located on high voltage platforms
and the lack of space inside the accelerator, in-house electronic cards based on micro-controllers and an optical fieldbus
were developed to collect data. VME processors under VxWorks, a real time operating system, manage the fieldbus, concentrate
the accelerator information and transmit it to the supervisory software through the ethernet network. This software consists
of a collection of Java virtual machines (JVM) running on several Unix work-stations and PCs under Windows. Some of the Java
virtual machines manage apparatus, instruments, local display and connections to an object database and VME concentrators.
Other manage general synoptics. JVMs communicate between themselves with RMI protocol and JRPC with VME concentrators. So
the supervisory software can be spread over several control stations throughout the network. 相似文献
12.
Dr. Hee‐Sun Han Paul G. Cantalupo Dr. Assaf Rotem Dr. Shelley K. Cockrell Martial Carbonnaux Prof. James M. Pipas Prof. David A. Weitz 《Angewandte Chemie (International ed. in English)》2015,54(47):13985-13988
Metagenomic studies suggest that only a small fraction of the viruses that exist in nature have been identified and studied. Characterization of unknown viral genomes is hindered by the many genomes populating any virus sample. A new method is reported that integrates drop‐based microfluidics and computational analysis to enable the purification of any single viral species from a complex mixed virus sample and the retrieval of complete genome sequences. By using this platform, the genome sequence of a 5243 bp dsDNA virus that was spiked into wastewater was retrieved with greater than 96 % sequence coverage and more than 99.8 % sequence identity. This method holds great potential for virus discovery since it allows enrichment and sequencing of previously undescribed viruses as well as known viruses. 相似文献
13.
A Multi‐Addressable Switch Based on the Dimethyldihydropyrene Photochrome with Remarkable Proton‐Triggered Photo‐opening Efficiency
下载免费PDF全文
![点击此处可从《Chemistry (Weinheim an der Bergstrasse, Germany)》网站下载免费的PDF全文](/ch/ext_images/free.gif)
Dr. Diego Roldan Dr. Saioa Cobo Dr. Frédéric Lafolet Dr. Neus Vilà Dr. Constance Bochot Dr. Christophe Bucher Prof. Dr. Eric Saint‐Aman Dr. Martial Boggio‐Pasqua Dr. Marco Garavelli Prof. Dr. Guy Royal 《Chemistry (Weinheim an der Bergstrasse, Germany)》2015,21(1):455-467
A series of photochromic derivatives based on the trans‐10b,10c‐dimethyl‐10b,10c‐dihydropyrene (DHP, “closed form”) skeleton has been synthesized and their photoisomerization leading to the corresponding cyclophanediene (CPD, “open form”) isomers has been investigated by UV/Vis and 1H NMR spectroscopies. Substitution of the DHP core with electron‐withdrawing pyridinium groups was found to have major effects on the photoisomerization efficiency, the most remarkable examples being to enhance the quantum yield of the opening reaction and to allow fast and quantitative conversions at much lower radiant energies. This effect was rationalized by theoretical calculations. We also show that the reverse reaction, that is, going from the open form to the closed form, can be electrochemically triggered by oxidation of the CPD unit and that the photo‐opening properties of pyridine‐substituted DHPs can be efficiently tuned by protonation, the system behaving as a multi‐addressable molecular switch. These multi‐addressable photochromes show promise for the development of responsive materials. 相似文献
14.
Abdellah I Boggio-Pasqua M Canac Y Lepetit C Duhayon C Chauvin R 《Chemistry (Weinheim an der Bergstrasse, Germany)》2011,17(18):5110-5115
The configurational stability of biaryl motifs is addressed for the 1-naphthyl-N-benzimidazolyl motif substituted by a single diphenylphosphinyl group at the 2-position. The atropoenantiomers of the N-methylated cation H-MIOP, a less sterically locked analogue of the neutral H-MOP ligand, were resolved by enantiospecific cleavage of the N(2)C-P bond of the resolved enantiomers of BIMIONAP. The latter were obtained by enantiospecific N-methylation of the previously resolved enantiomers of neutral BIMINAP. PdCl(2) complexes of the P,C-chelating N-heterocyclic carbene (NHC)-phosphine ligands derived from (R)- and (S)-H-MIOP were prepared by two enantiospecific routes: by N(2)C-P bond cleavage from the (R)- and (S)-BIMIONAP-PdCl(2) complexes, or by simultaneous coordination of the P and C atoms of the in situ generated free NHC-phosphine. The enantiomerization pathways of H-MOP, H-MIOP, and corresponding NHC-phosphine have been investigated at the B3PW91/6-31G(d,p) level of theory. The calculated enantiomerization barriers of H-MOP and H-MIOP in acetonitrile are equal to 176.0 and 146.4 kJ mol(-1), respectively, and are mainly determined by the distortion of the naphthalene and/or benzimidazole motifs in the transition state. Beyond the stability of their optical rotation at room temperature, the respective calculated Oki's racemization temperatures of 334 and 225 °C allowed us to consider both ligands as configurationally stable. 相似文献
15.
Martial Mazars 《Molecular physics》2013,111(13-14):1927-1936
Yukawa potentials may be long-ranged when the Debye screening length is large. In computer simulations, such long-ranged potentials have to be taken into account with convenient algorithms to avoid systematic bias in the sampling of the phase space. Recently, we provided Ewald sums for quasi-two-dimensional systems with Yukawa interaction potentials [J. Chem. Phys. 126, 056101 (2007); Molec. Phys. paper I of this series]. Sometimes, Lekner sums are used as an alternative to Ewald sums for Coulomb systems. In the present work, we derive the Lekner sums for quasi-two-dimensional systems with Yukawa interaction potentials and we give numerical tests for practical implementations. The main result of this paper is to emphasize that Lekner sums cannot be considered as an alternative to Ewald sums for Yukawa potentials. As a conclusion to this work: Lekner sums should not be used for quasi-two-dimensional systems with Yukawa interaction potentials. 相似文献
16.
Bas B. Van Aken Martial Duchamp Chris B. Boothroyd Rafal E. Dunin-Borkowski Wim J. Soppe 《Journal of Non》2012,358(17):2179-2182
The p-type Si layer in a-Si and μc-Si solar cells on foil needs to fulfil several important requirements. The layer is necessary to create the electric field that separates the photo-generated charge carriers; the doping also increases the conductivity to conduct the photocurrent to the front contact; on the other hand, the p-layer should transmit the incident light efficiently to the intrinsic absorber layer. We show that it is possible to study TEM samples prepared, for analysis of possible layer defects, by focussed ion beam milling to detect boron and carbon concentrations as low as 1020 cm-3, using core-loss EELS combined with numerical analysis. We control the band gap and activation energy of p-a-SiC by varying the B2H6 and CH4 flow during deposition in the process chamber. We have found a linear relation between the activation energy of the dark conductivity Eact and the optical band gap E04. Modelling shows that the optimum efficiency in nip solar cells is obtained when the p-a-SiC band gap is slightly larger than the band gap of the absorber layer. We have assessed the potential of core-loss EELS for detecting B and C concentrations as low as 1020 cm-3 in a spatially resolved manner, and of low-loss EELS as a probe of the local variations in plasmon energy. 相似文献
17.
Juan Sanz García Martial Boggio-Pasqua Ilaria Ciofini Marco Campetella 《Journal of computational chemistry》2019,40(14):1420-1428
The ability to locate minima on electronic excited states (ESs) potential energy surfaces both in the case of bright and dark states is crucial for a full understanding of photochemical reactions. This task has become a standard practice for small- to medium-sized organic chromophores thanks to the constant developments in the field of computational photochemistry. However, this remains a very challenging effort when it comes to the optimization of ESs of transition metal complexes (TMCs), not only due to the presence of several electronic ESs close in energy, but also due to the complex nature of the ESs involved. In this article, we present a simple yet powerful method to follow an ES of interest during a structural optimization in the case of TMCs, based on the use of a compact hole-particle representation of the electronic transition, namely the natural transition orbitals (NTOs). State tracking using NTOs is unambiguously accomplished by computing the mono-electronic wave function overlap between consecutive steps of the optimization. Here, we demonstrate that this simple but robust procedure works not only in the case of the cytosine but also in the case of the ES optimization of a ruthenium nitrosyl complex which is very problematic with standard approaches. © 2019 The Authors. Journal of Computational Chemistry published by Wiley Periodicals, Inc. 相似文献
18.
Elarbi Chatir Dr. Martial Boggio-Pasqua Prof. Frederique Loiseau Dr. Christian Philouze Prof. Guy Royal Dr. Saioa Cobo 《Chemistry (Weinheim an der Bergstrasse, Germany)》2022,28(7):e202103755
A phenanthrene unit has been functionalized by several methylthiophene units in order to bring it a photochromic behavior. These compounds were characterized by NMR, absorption and emission spectroscopies, theoretical calculations as well as cyclic voltammetry. The association of a phenanthrene group with a photochromic center could open the door to a new generation of organic field-effect transistors. 相似文献
19.
20.
Moriou C Thomas M Adeline MT Martin MT Chiaroni A Pochet S Fourrey JL Favre A Clivio P 《The Journal of organic chemistry》2007,72(1):43-50
The 3'-N-sulfamate analogue of thymidylyl(3'-5')thymidine (TnsoT, 1) exhibits a preference for a C3'-endo conformation in the solution and solid states. Its photochemical behavior in solution is compared to that of its natural counterpart, thymidylyl(3'-5')thymidine (TpT, 2), to get further insight into the significance of the C3'-endo conformation on the photoproduct formation at the single-stranded dinucleotide level. Irradiation at 254 nm of 1 led to the same type of photoproducts as observed with 2. However, 1 was significantly more photoreactive than 2, and accordingly, the initial rate of photoproduct formation was enhanced in accordance with its propensity to base stack compared to 2. The corresponding quantum yields were determined and showed that the enhancement factor (1 compared to 2) is moderate for the cyclobutane pyrimidine dimer (CPD) (1.26) and much higher for the (6-4) photoproduct (1.8). These data strongly suggest that the CPD and (6-4) photoproduct arise from distinct minor stacked conformations. 相似文献