全文获取类型
收费全文 | 4157篇 |
免费 | 1130篇 |
国内免费 | 744篇 |
专业分类
化学 | 3317篇 |
晶体学 | 114篇 |
力学 | 116篇 |
综合类 | 58篇 |
数学 | 70篇 |
物理学 | 2356篇 |
出版年
2024年 | 13篇 |
2023年 | 40篇 |
2022年 | 149篇 |
2021年 | 148篇 |
2020年 | 165篇 |
2019年 | 120篇 |
2018年 | 115篇 |
2017年 | 197篇 |
2016年 | 235篇 |
2015年 | 197篇 |
2014年 | 294篇 |
2013年 | 650篇 |
2012年 | 340篇 |
2011年 | 349篇 |
2010年 | 273篇 |
2009年 | 239篇 |
2008年 | 241篇 |
2007年 | 284篇 |
2006年 | 287篇 |
2005年 | 266篇 |
2004年 | 236篇 |
2003年 | 226篇 |
2002年 | 223篇 |
2001年 | 107篇 |
2000年 | 111篇 |
1999年 | 86篇 |
1998年 | 59篇 |
1997年 | 56篇 |
1996年 | 56篇 |
1995年 | 50篇 |
1994年 | 34篇 |
1993年 | 35篇 |
1992年 | 32篇 |
1991年 | 17篇 |
1990年 | 14篇 |
1989年 | 14篇 |
1988年 | 8篇 |
1987年 | 7篇 |
1986年 | 6篇 |
1985年 | 8篇 |
1984年 | 5篇 |
1983年 | 2篇 |
1982年 | 11篇 |
1981年 | 5篇 |
1980年 | 9篇 |
1979年 | 7篇 |
1977年 | 2篇 |
1976年 | 1篇 |
1975年 | 1篇 |
1974年 | 1篇 |
排序方式: 共有6031条查询结果,搜索用时 468 毫秒
61.
1INTRODUCTIONInthepastfewyears,potassiumchannelacti-vatorshavegainedincreasingattentionbecauseoftheirclinicalpotentialapplicationsinvariousdiseases.Oneofthemostpotentcompoundsamongthisnewclassofdrugsisthebenzopyranderivativecroma-kalim[1~4].Benzopyranaswellasitsderivativesex-hibitsextensivepharmacologicalandbiologicalacti-vities[5],suchasantibacterialactivities[6,,antitumor7]activity[8],hypotensiveeffect[9],antiproliferationef-fect[10],etc.Thetitlecompoundbearingabenzo-pyranstructuraluni… 相似文献
62.
A. Y. Lee 《Journal of Optimization Theory and Applications》1987,52(1):151-162
Bounded terminal conditions of nonlinear optimization problems are converted to equality terminal conditions via the Valentine's device. In so doing, additional unknown parameters are introduced into the problem. The transformed problems can still be easily solved using the sequential gradient-restoration algorithm (SGRA) via a simple augmentation of the unknown parameter vector . Three example problems with bounded terminal conditions are solved to verify this technique.This research was supported in part by the National Aeronautics and Space Administration under NASA Grant No. NCC 2-106. 相似文献
63.
伯溴代烷的微波快速合成法 总被引:3,自引:0,他引:3
198 6年R .J.Gignere[1 ] 和R .Gedye[2 ] 首次报道将微波用于有机合成反应以来 ,大量实验事实证明[3] 微波不仅能极大地提高某些化学反应速率 ,而且能使一些在常规加热条件下几乎不能进行的反应得以完成、获得满意的收率。用伯醇在溴化氢溶液中微波条件下发生反应制备了伯溴代烷。1 实验部分WhirlpoolT1 2 0X微波炉 (四川大学无线电系改装 ,可连续发射微波 ,功率连续可调 )、WZS -I阿贝折光仪 (未校正 )。工业溴化氢 (C =40 % ,d =1 38) ,其余试剂均为CP级。合成通法 将适量的醇、一定量的浓硫酸和过… 相似文献
64.
65.
Òscar Rubio-Pons Boris Minaev Oleksandr Loboda Hans Ågren 《Theoretical chemistry accounts》2005,113(1):15-27
The phosphorescence spectrum of p-dichlorobenzene has been calculated using multiconfiguration self-consistent-field wave functions and the quadratic response technique. Attention has been paid to the intensity distribution of the singlet–triplet (3B1u1Ag) transition through a number of vibronic subbands. The second order spin–orbit coupling (SOC) contribution to the spin splitting of the 3B1u (3*) state is found to be almost negligible, and the calculations therefore provide a good estimate for the zero-field splitting (ZFS) parameters based only on the electron spin–spin coupling expectation values. Nuclear quadrupole resonance constants for the different Cl isotopes are also calculated to accomplish the ZFS assignment. The electric dipole activity of the spin sublevels in the triplet–singlet transitions to the ground-state vibrational levels is estimated by calculations of derivatives using distorted geometries which are shifted from the equilibrium position along different vibrational modes. A vibrational analysis of the phosphorescence spectrum, based on the SOC-induced mixing of the singlet and triplet states calculated along different vibrational modes, provides reasonable agreement with experimental data.Acknowledgment O. R.-P. would like to thank the European MOLPROP network for support. The authors thank Alexander Baev for fruitful discussions. This work was supported by the Swedish Royal Academy of Science (KVA). 相似文献
66.
标题化合物C24H29NO4?1/2C2H5OH稨2O)由香兰素、5,5-二甲基-1,3-环己二酮、醋酸铵在微波辐射下干反应并经95%乙醇重结晶而得C24H29NO4穀2(C2H5OH稨2O)晶体。结构通过单晶X-射线衍射法确定,其晶体属单斜晶系,空间群P21/n, a = 9.810(2), b = 14.516(3), c = 17.008(3) ? b = 101.03(2), V = 2377.2(8) ?, Z = 4, Mr = 427.52, Dc = 1.195 g/cm3 , m(MoKa) = 0.082 mm-1, F(000) = 920。晶体结构用直接法解出,经全矩阵最小二乘法对原子参数进行修正,最终的偏离因子为R = 0.0406, wR = 0.0892。X-射线衍射分析结果表明,吡啶环和与之稠合的2个六员环均为信封式构象。 相似文献
67.
In a microwave study a program was designed for thermal regulation. This software allows different types of regulations: P, PI, PD or PID (proportional integration derivation). Results obtained with PID and PI regulation for different previous linear heating schedules (1 deg·s?1 and 0.15 deg·s?1) imposed on a polymer sample (DGEBA/3DCM) up to 280°C and more are reported. Mathematical resolution of thermal laws applied to the sample permits the regulation constants (T i,T d andG s) to be linked to the physical features of the polymer. A method used to calculate: the reflexion constant of the wave on the polymer, ρ and the diminution factor, α is presented. 相似文献
68.
Microwave synthesis,characterization and catalytic properties of titanium-incorporated ZSM-5 zeolite
Taihuan Jin Young Kyu Hwang Do-Young Hong Sung Hwa Jhung Jin-Soo Hwang San-Eon Park Young Ho Kim Jong-San Chang 《Research on Chemical Intermediates》2007,33(6):501-512
Titanium-incorporated ZSM-5 zeolites (Si/Al = 50–200 and Si/Ti = 70) were successfully synthesized in a one-step sol-gel process
under microwave irradiation. The characteristics of Ti-ZSM-5 zeolites were investigated using X-ray power diffraction, UV/Vis-DRS,
FT-IR spectroscopy and solid-state 27Al-NMR to monitor the physico-chemical properties. Simultaneously, the acidic properties were characterized by the NH3-TPD profile. The characterization results revealed that the Ti4+ and Al3+ ions were well incorporated into the framework of Ti-ZSM-5 zeolite. The prepared zeolite was moderately active but selective
in the dehydration of methanol to dimethyl ether. 相似文献
69.
Akitomo Tachibana Yoshihiro Asai Shogo Ikeuchi Shigeru Ishikawa Tokio Yamabe 《Theoretical chemistry accounts》1990,78(1):1-9
Summary The vibronic character of this molecular device has been studied using isomorphic electron orbitals. The leading role of the softest vibrational mode for the electron transport process is stressed by the quantum mechanical treatment of the rearrangement operator. The theory was used to investigate the possible function of the soliton valve, which has been suggested as a switching tip. The electronic flexibility of the cyclopropenyl radical with respect to molecular vibrations, which is important for the function of the molecular device, is well characterized by the hardness and softness of the electron structure in terms of the orbital energy-occupation number correlation diagram. 相似文献
70.
Serhat Varis 《European Polymer Journal》2006,42(10):2352-2360
A new soluble polythiophene derivative was synthesized by both chemical and electrochemical oxidative polymerization of 1-4-nitrophenyl-2,5-di(2-thienyl)-1H-pyrrole (SNSNO2). Chemical method produces a polymer which is completely soluble in organic solvents. The structures of both the monomer and the soluble polymer were elucidated by 1H and 13C-NMR and FTIR. The average molecular weight has been determined by GPC to be Mn = 6.3 × 103 for the chemically synthesized polymer. P(SNSNO2) was also synthesized via potentiostatic electrochemical polymerization. Characterizations of the resulting polymer were performed by cyclic voltammetry CV, FTIR and UV-Vis spectroscopy. Four-probe technique was used to measure the conductivities of the samples. Moreover, the spectroelectrochemical and electrochromic properties of the polymer film were investigated. In addition, dual type polymer electrochromic devices ECDs based on P(SNSNO2) with poly3,4-ethylenedioxythiophene (PEDOT) were constructed. Spectroelectrochemistry, electrochromic switching and open circuit stability of the devices were studied. They were found to have good switching times, reasonable contrasts and optical memories. 相似文献