全文获取类型
收费全文 | 941篇 |
免费 | 145篇 |
国内免费 | 144篇 |
专业分类
化学 | 560篇 |
晶体学 | 15篇 |
力学 | 332篇 |
综合类 | 8篇 |
数学 | 119篇 |
物理学 | 196篇 |
出版年
2024年 | 2篇 |
2023年 | 14篇 |
2022年 | 33篇 |
2021年 | 44篇 |
2020年 | 68篇 |
2019年 | 50篇 |
2018年 | 40篇 |
2017年 | 44篇 |
2016年 | 62篇 |
2015年 | 41篇 |
2014年 | 41篇 |
2013年 | 92篇 |
2012年 | 67篇 |
2011年 | 61篇 |
2010年 | 46篇 |
2009年 | 41篇 |
2008年 | 41篇 |
2007年 | 39篇 |
2006年 | 44篇 |
2005年 | 38篇 |
2004年 | 28篇 |
2003年 | 42篇 |
2002年 | 38篇 |
2001年 | 26篇 |
2000年 | 19篇 |
1999年 | 31篇 |
1998年 | 24篇 |
1997年 | 14篇 |
1996年 | 12篇 |
1995年 | 12篇 |
1994年 | 10篇 |
1993年 | 17篇 |
1992年 | 7篇 |
1991年 | 5篇 |
1990年 | 2篇 |
1989年 | 4篇 |
1988年 | 8篇 |
1987年 | 1篇 |
1986年 | 2篇 |
1985年 | 7篇 |
1984年 | 3篇 |
1983年 | 1篇 |
1981年 | 2篇 |
1978年 | 1篇 |
1971年 | 1篇 |
1957年 | 4篇 |
1936年 | 1篇 |
排序方式: 共有1230条查询结果,搜索用时 234 毫秒
71.
72.
Timothy H. Click Aibing Liu George A. Kaminski 《Journal of computational chemistry》2011,32(3):513-524
We have simulated pure liquid butane, methanol, and hydrated alanine polypeptide with the Monte Carlo technique using three kinds of random number generators (RNG's)—the standard Linear Congruential Generator (LCG), a modification of the LCG with additional randomization used in the BOSS software, and the “Mersenne Twister” generator by Matsumoto and Nishimura. While using the latter two RNG's leads to reasonably similar physical features, the LCG produces significant different results. For the pure fluids, a noticeable expansion occurs. Using the original LCG on butane yields, a molecular volume of 171.4 Å3 per molecule compared to about 163.6–163.9 Å3 for the other two generators, a deviation of about 5%. For methanol, the LCG produces an average volume of 86.3 Å3 per molecule, which is about 24% higher than the 68.8–70.2 Å3 obtained with the RNG's in BOSS and the generator by Matsumoto and Nishimura. In case of the hydrated tridecaalanine peptide, the volume and energy tend to be noticeably greater with the LCG than with the BOSS (modified LCG) RNG's. For the simulated hydrated extended conformation of tridecaalanine, the difference in volume reached about 87%. The uniformity and periodicity of the generators do not seem to play the crucial role in these phenomena. We conclude that, it is important to test a RNG's by modeling a system such as the pure liquid methanol with a well‐established force field before routinely employing it in Monte Carlo simulations. © 2010 Wiley Periodicals, Inc. J Comput Chem, 2011 相似文献
73.
We propose a two-color scheme of atom waveguides and one-dimensional (1D) optical lattices using evanescent wave fields of different transverse modes around an optical micro/nano-fiber. The atom guide potential can be produced when the optical fiber carries a red-detuned light with TE01 mode and a blue-detuned light with HEll mode, and the 1D optical lattice potential can be produced when the red-detuned light is transformed to the superposition of the TE01 mode and HE11 mode. The two trapping potentials can be transformed to each other for accurately controlling mode transformation for the red-detuned light. This might provide a new approach to realize flexible transition between the guiding and trapping states of atoms. 相似文献
74.
75.
Yao-Yi Cheng Peggy Cebe Malcolm Capel Heidi Schreuder-Gibson Aaron Bluhm Walter Yeomans 《Journal of Polymer Science.Polymer Physics》1995,33(17):2331-2341
Crystallization and melting behavior are studied by small-angle X-ray scattering (SAXS) for a series of recently synthesized monotropic liquid crystalline polycarbonates based on α-methyl stilbene mesogen and methylene flexible spacer. The one-dimensional electron density correlation function is used to obtain long period, crystal thickness, and linear crystallinity from the Lorentz-corrected SAXS intensity. Changes in these parameters during nonisothermal crystallization and melting are explained by a model of dual crystal populations. The primary crystals form first using the liquid crystalline phase as crystal nuclei, while smaller and less perfect crystals form later from the isotropic phase at low temperature. The results of the real-time SAXS study of isothermal crystallization also support the view that the nematic phase serves as crystal nuclei for fast crystallization. An odd-even effect in crystal thickness and linear crystallinity is observed in all the SAXS experiments mentioned above. The results of this study and our complementary wide-angle X-ray scattering (WAXS) investigation show clearly that the difference in the position of the neighboring carbonate dipoles on a chain affects structural organization both at the unit cell level and at the level of the crystal in these monotropic LCPs. © 1995 John Wiley & Sons, Inc. 相似文献
76.
The optimizer developed for the Mining Minima algorithm, which uses ideas from Genetic Algorithms, the Global Underestimator Method, and Poling, has been adapted for use in ligand-receptor docking. The present study describes the resulting methodology and evaluates its accuracy and speed for 27 test systems. The performance of the new docking algorithm appears to be competitive with that of previously published methods. The energy model, an empirical force field with a distance-dependent dielectric treatment of solvation, is adequate for a number of test cases, although incorrect low-energy conformations begin to compete with the correct conformation for larger sampling volumes and for highly solvent-exposed binding sites that impose little steric constraint on the ligand. 相似文献
77.
The dimensionless partial differential equations governing thedynamics of a thin flexible isotropic plate with an external load arederived and investigated. The period doubling bifurcations, as well asthe chaotic dynamics, are detected and analyzed. The algorithms leadingto the reduction of the original equations to those of a difference setof ordinary differential and algebraic equations are proposed, comparedto other known methods, and then applied to the problem.Among others, it is shown that, in spite of the system complexity, theFeigenbaum scenario exhibited by one-dimensional maps also governs theroute to chaos in the continuous system under consideration. 相似文献
78.
研究了使用电化学沉积法于碱性条件下在柔性ITO衬底上制备Cu/Cu2O薄膜的方法。循环伏安曲线表明Cu2O与Cu的阴极峰分别位于-500 mV(vs Ag/AgCl)和-800 mV(vs Ag/AgCl)附近。利用循环伏安法考察了生长温度和电解液pH值等对Cu2O与Cu阴极峰电位的影响,阴极峰随生长温度的升高以及pH值的降低而略向阳极移动,沉积电流也随之相应增大。与弱酸性条件相比,上述两个阴极峰随pH值升高而移动的程度明显减小,这可能与碱性条件下C3H6O电离程度增大以及C3H6O根作为配体的过量程度有关。通过X射线衍射光谱和扫描电子显微镜的表征证实,在所研究的生长温度区间和pH值内可利用电化学沉积法在柔性ITO衬底上制备Cu/Cu2O纳米混晶薄膜。在相同的生长温度和pH条件下,电化学沉积电位对样品表面形貌和晶体性质具有较大影响。 相似文献
79.
Kang‐Jun Baeg Dongyoon Khim Dong‐Yu Kim Soon‐Won Jung Jae Bon Koo In‐Kyu You Henry Yan Antonio Facchetti Yong‐Young Noh 《Journal of Polymer Science.Polymer Physics》2011,49(1):62-67
Inkjet‐printed high speed polymeric complementary circuits are fabricated using an n‐type ([poly{[N,N′‐bis(2‐octyldodecyl)‐naphthalene‐1,4,5,8‐bis(dicarboximide)‐2,6‐diyl]‐alt‐5,5′‐(2,2′‐dithiophene)} [P(NDI2OD‐T2), Polyera ActivInk N2200] and two p‐type polymers [poly(3‐hexylthiophene) (P3HT) and a dithiophene‐based polymer (Polyera ActivInk P2100)]. The top‐gate/bottom‐contact (TG/BC) organic field‐effect transistors (OFETs) exhibit well‐balanced and very‐high hole and electron mobilities (μFET) of 0.2–0.5 cm2/Vs, which were enabled by optimization of the inkjet‐printed active features, small contact resistance both of electron and hole injections, and effective control over gate dielectrics and its orthogonal solvent effect (selection of poly(methyl methacrylate) and 2‐ethoxyethanol). Our first demonstrated inkjet‐printed polymeric complementary devices have been integrated to high‐performance complementary inverters (gain >30) and ring oscillators (oscillation frequency ~50 kHz). We believe that the operating frequency of printable organic circuits can be further improved more than 10 MHz by fine‐tuning of the device architecture and optimization of the p‐ and n‐channel semiconductor processing. © 2010 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys, 2010 相似文献
80.
Valerio Zardetto Thomas M. Brown Andrea Reale Aldo Di Carlo 《Journal of Polymer Science.Polymer Physics》2011,49(9):638-648
Designing and developing flexible electronics requires a thorough investigation of the substrates available for the fabrication of devices. Here, we present a practical study on a variety of significant substrates: polyethylene terephthalate (PET), its heat‐stabilized (HS) derivative, HS‐PET, and polyethylene naphthalate (PEN) plastic insulating films; indium tin oxide (ITO)‐coated ITO/PEN and ITO/PET transparent conducting films; rigid ITO/glass and FTO/glass substrates; stainless steel and titanium foils. We put the substrates through a range of tests these actually undergo during device fabrication to determine their optical, mechanical flexibility (under different types of tensile and compressive stress bending with and without a PEDOT:PSS conducting polymer layer), solvent resistance, stability to temperature treatment (conductivity and deformation), and to UV irradiation. We highlight issues and propose solutions to improve substrate response. The results and thresholds extracted reveal limitations and windows of opportunity useful for the designer of flexible optoelectronics in determining manufacturing processes and the final applications under everyday operation. © 2011 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys, 2011 相似文献