全文获取类型
收费全文 | 1397篇 |
免费 | 52篇 |
国内免费 | 8篇 |
专业分类
化学 | 561篇 |
晶体学 | 21篇 |
力学 | 64篇 |
数学 | 420篇 |
物理学 | 391篇 |
出版年
2023年 | 10篇 |
2022年 | 15篇 |
2021年 | 29篇 |
2020年 | 21篇 |
2019年 | 28篇 |
2018年 | 32篇 |
2017年 | 46篇 |
2016年 | 43篇 |
2015年 | 33篇 |
2014年 | 48篇 |
2013年 | 119篇 |
2012年 | 79篇 |
2011年 | 99篇 |
2010年 | 75篇 |
2009年 | 60篇 |
2008年 | 70篇 |
2007年 | 57篇 |
2006年 | 45篇 |
2005年 | 39篇 |
2004年 | 38篇 |
2003年 | 36篇 |
2002年 | 26篇 |
2001年 | 17篇 |
2000年 | 21篇 |
1999年 | 18篇 |
1998年 | 13篇 |
1997年 | 7篇 |
1996年 | 17篇 |
1995年 | 11篇 |
1994年 | 11篇 |
1993年 | 14篇 |
1992年 | 11篇 |
1991年 | 14篇 |
1988年 | 8篇 |
1987年 | 9篇 |
1986年 | 7篇 |
1985年 | 20篇 |
1984年 | 12篇 |
1983年 | 15篇 |
1982年 | 20篇 |
1981年 | 9篇 |
1980年 | 16篇 |
1979年 | 18篇 |
1978年 | 10篇 |
1977年 | 11篇 |
1976年 | 13篇 |
1975年 | 11篇 |
1974年 | 7篇 |
1973年 | 11篇 |
1972年 | 7篇 |
排序方式: 共有1457条查询结果,搜索用时 31 毫秒
51.
Observation of Slow Relaxation and Single‐Molecule Toroidal Behavior in a Family of Butterfly‐Shaped Ln4 Complexes 下载免费PDF全文
Sourav Biswas Dr. Sourav Das Tulika Gupta Dr. Saurabh Kumar Singh Dr. Michael Pissas Dr. Gopalan Rajaraman Prof. Vadapalli Chandrasekhar 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(51):18532-18550
A family of five isostructural butterfly complexes with a tetranuclear [Ln4] core of the general formula [Ln4(LH)2(μ2‐η1η1Piv)(η2‐Piv)(μ3‐OH)2]?x H2O?y MeOH?z CHCl3 ( 1 : Ln=DyIII, x=2, y=2, z=0; 2 : Ln=TbIII, x=0, y=0, z=6; 3 : Ln=ErIII, x=2, y=2, z=0; 4 : Ln=HoIII, x=2, y=2, z=0; 5 : Ln=YbIII, x=2, y=2, z=0; LH4=6‐{[bis(2‐hydroxyethyl)amino]methyl}‐N′‐(2‐hydroxy‐3‐methoxybenzylidene)picolinohydrazide; PivH=pivalic acid) was isolated and characterized both structurally and magnetically. Complexes 1 – 5 were probed by direct and alternating current (dc and ac) magnetic susceptibility measurements and, except for 1 , they did not display single‐molecule magnetism (SMM) behavior. The ac magnetic susceptibility measurements show frequency‐dependent out‐of‐phase signals with one relaxation process for complex 1 and the estimated effective energy barrier for the relaxation process was found to be 49 K. We have carried out extensive ab initio (CASSCF+RASSI‐SO+SINGLE_ANISO+POLY_ANISO) calculations on all the five complexes to gain deeper insights into the nature of magnetic anisotropy and the presence and absence of slow relaxation in these complexes. Our calculations yield three different exchange coupling for these Ln4 complexes and all the extracted J values are found to be weakly ferro/antiferromagentic in nature (J1=+2.35, J2=?0.58, and J3=?0.29 cm?1 for 1 ; J1=+0.45, J2=?0.68, and J3=?0.29 cm?1 for 2 ; J1=+0.03, J2=?0.98, and J3=?0.19 cm?1 for 3 ; J1=+4.15, J2=?0.23, and J3=?0.54 cm?1 for 4 and J1=+0.15, J2=?0.28, and J3=?1.18 cm?1 for 5 ). Our calculations reveal the presence of very large mixed toroidal moment in complex 1 and this is essentially due to the specific exchange topology present in this cluster. Our calculations also suggest presence of single‐molecule toroics (SMTs) in complex 2 . For complexes 3 – 5 on the other hand, the transverse anisotropy was computed to be large, leading to the absence of slow relaxation of magnetization. As the magnetic field produced by SMTs decays faster than the normal spin moments, the concept of SMTs can be exploited to build qubits in which less interference and dense packing are possible. Our systematic study on these series of Ln4 complexes suggest how the ligand design can help to bring forth such SMT characteristics in lanthanide complexes. 相似文献
52.
Prashant Mishra Kaman Singh Utkarsh Dixit Ankita Agarwal Rayees Ahmad Bhat 《印度化学会志》2022,99(7):100528
The threat of phenol contamination in aquatic ecosystems is significant for the health of the earth's water systems as well as all humans on it. The present study was conducted to synthesize a cost-effective adsorbent (pea shells activated with sulfuric acid, PSASA) from agriculture waste (pea shells) and its use for effective removal of toxic 4-Aminophenol (4-AP). Newly designed PSASA exhibited significant adsorption of 4-AP which was confirmed by SEM, FT-IR, and XRD analysis. Surface topography confirmed high unevenness of the PSASA surface and the macroporous feature of the PSASA was confirmed by BET analysis. . Multiple testing was done to see how various factors affected adsorption such as adsorbent dose, temperature, pH, PZC, the effect of KCl and urea addition and the effect of the initial concentration of 4-AP. A drop in adsorption uptake of 4-AP was observed as the temperature increases from 25 °C to 45 °C. Maximum adsorption uptake (qm) was found to be 106.11 mg/g at an optimum pH of 7.0 and 25 °C. Among various adsorption isotherm models tested, Langmuir Isotherm gave the best explanation with high R2 values of experimental data. The pseudo-first-order model was found to explain the kinetics of adsorption well. The thermodynamic finding confirms the adsorption process was physical and exothermic. The adsorption of 4-AP was primarily governed by electrostatic interaction, hydrogen-bonding and π-π exchange mechanism. Because of the positive outcomes of the present research, we can use the PSASA as a cost-effective adsorbent for removing phenolic compounds. 相似文献
53.
Saurabh B. Ganorkar Suraj R. Chaudhari Preeti S. Bobade Sagar H. Pawar Atul A. Shirkhedkar 《Biomedical chromatography : BMC》2022,36(5):e5345
Rufinamide is used presently to treat Lenaux–Gastaut syndrome. A full factorial design and desirability approach was investigated for the optimization of hydrolytic stress via response surface curves (RSCs). The degradation impurities were identified and resolved using reversed-phase high-performance liquid chromatography (RP-HPLC) on the Qualisil® BDS C8 column. Acetonitrile–water (29:71, v/v) was optimized for the mobile phase and used at a flow rate of 1.0 ml/min with detection at a wavelength of 230 nm. Rufinamide showed appreciable susceptibility to hydrolysis under acidic and alkaline stress, and substantial degradation in the neutral condition. It degraded much less under oxidative stress. Exposure towards thermal and photolytic stress conditions indicated appreciable stability. The developed method was subjected to validation as per the recommendations of the International Conference on Harmonization. The proposed method showed no influence from the excipients and the degradation products. As well as good precision and accuracy in determination, the method showed a linear response between 2 and 12 μg ml−1. The method was extended for determination in a human plasma sample, which resulted in excellent recovery without interference from matrix effects. The combined use of desirability and design for the optimization of acidic and alkaline hydrolytic stress led to simple and rapid analysis. 相似文献
54.
55.
Ravi P. Agarwal B. Kovacs D. O’Regan 《Journal of Applied Mathematics and Computing》2014,44(1-2):437-454
This paper investigates the existence of positive solutions for a sixth-order differential system with three variable parameters. Using a fixed point theorem and an operator spectral theorem we give some new existence results. 相似文献
56.
57.
58.
GPU‐accelerated direct numerical simulations of decaying compressible turbulence employing a GKM‐based solver 下载免费PDF全文
Gas Kinetic Method‐based flow solvers have become popular in recent years owing to their robustness in simulating high Mach number compressible flows. We evaluate the performance of the newly developed analytical gas kinetic method (AGKM) by Xuan et al. in performing direct numerical simulation of canonical compressible turbulent flow on graphical processing unit (GPU)s. We find that for a range of turbulent Mach numbers, AGKM results shows excellent agreement with high order accurate results obtained with traditional Navier–Stokes solvers in terms of key turbulence statistics. Further, AGKM is found to be more efficient as compared with the traditional gas kinetic method for GPU implementation. We present a brief overview of the optimizations performed on NVIDIA K20 GPU and show that GPU optimizations boost the speedup up‐to 40x as compared with single core CPU computations. Hence, AGKM can be used as an efficient method for performing fast and accurate direct numerical simulations of compressible turbulent flows on simple GPU‐based workstations. Copyright © 2016 John Wiley & Sons, Ltd. 相似文献
59.
60.