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1.
E. K. Merabet H. K. Yuen W. A. Grote K. L. Deppermann 《Journal of Thermal Analysis and Calorimetry》1994,42(5):895-906
A new sensitive isothermal titration microcalorimeter using polyvinylidene difluoride (PVDF) as detector has been developed. Heat pulses of less than 0.4 μJ can be detected and the baseline noise level (p-p) is 40 nW. The calorimeter is constructed with one reaction cell (0.7 ml) insulated by several radiation shields inside a vacuum chamber. The performance of the instrument was examined by measuring the heat of protonation of Tris with HCl. The enthalpy of reaction was found to be ?49±1 kJ·mol?1, in good agreement with the reported value of ?47.5 kJ·mol?1. 相似文献
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利用磁控溅射的方法在氧化后的单晶Si基片上制备了TiNi形状记忆合金薄膜,利用示差扫描量热法和原位X射线衍射研究了薄膜的马氏体相变特征。通过60keV质子注入(辐照)薄膜样品研究了H+离子对合金薄膜马氏体相变特征的影响,结果表明氢离子注入后引起了马氏体相变开始Ms和结束点Mf以及逆马氏体相变开始As和结束温度Af的下降,而对R相变开始Rs和结束温度Rf影响不大。掠入射X射线衍射表明H+离子注入后有氢化物形成。H+离子注入形成的氢化物是引起相变点的变化的主要因素。 相似文献
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We present two methods for the creation of two-particle entangled states of excitons in a coupled quantum dot system. The system contains two identical quantum dots that are coupled by an inter-dot hopping process. The manipulation of the system is succeeded by proper application of an external laser field. 相似文献
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Polycrystalline perovskite La0.67Ca0.33MnO3 was synthesized by a sol–gel method. Its adiabatic temperature change ΔTad induced by a magnetic field change was measured directly. At 268 K, near its Curie temperature TC, ΔTad of La0.67Ca0.33MnO3 induced by a magnetic field change of 2.02 T reaches 2.4 K. The latent heat Q and magnetic entropy change −ΔSM induced by a magnetic field change were calculated from the temperature dependence of ΔTad and zero-field heat capacity Cp. The maximum values of Q and −ΔSM in La0.67Ca0.33MnO3 induced by a magnetic field change of 2.02 T are 1.85 J g−1 and 6.9 J kg−1 K−1, respectively. The former is larger than the phase transition latent heat of heating or cooling, which is about 1.70 J g−1. 相似文献
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利用精密自动绝热热量计直接测定了配合物Zn(Phe)(NO3)2·H2O(s) (Phe:苯丙氨酸)在78-370 K温区的摩尔热容. 通过热容曲线的解析得到该配合物的起始脱水温度为, T0=(324.27±0.37) K. 将该温区的摩尔热容实验值用最小二乘法拟合得到摩尔热容(Cp, m)对温度(T)的多项式方程, 并且在此基础上计算出了它的舒平热容值和各种热力学函数值. 依据Hess定律, 通过设计热化学循环, 选择体积为100 mL浓度为2 mol·L-1 的盐酸作为量热溶剂, 利用等温环境溶解-反应热量计分别测定混合物{ZnSO4·7H2O(s)+2NaNO3(s)+L-Phe(s)}和{Zn(Phe)(NO3)2·H2O(s)+Na2SO4(s)}的溶解焓为, ⊿dH0m,1 =(69.42±0.05) kJ·mol-1, ⊿dH0 m,2 =(48.14±0.04) kJ·mol-1, 进而计算出该配合物的标准摩尔生成焓为, ⊿fH0m =-(1363.10±3.52) kJ·mol-1. 另外, 利用紫外-可见(UV-Vis)光谱和折光指数(refractiveindex)的测量结果检验了所设计的热化学循环的可靠性. 相似文献
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摘要运用多参考微扰理论(Multireference MΦller-Plesset theory)计算了SSCH3垂直激发能及其S-C与S-S两种断键方式的绝热(Adiabatic)与非绝热(Diabatic)的基态和激发态势能曲线, 研究了在193nm激光作用下SSCH3的光解离过程, 理论计算值与实验值相符. 相似文献
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HeI photoelectron spectra have been recorded for the reaction of atomic fluorine with ethyl chloride at different reaction times. A structured band associated with a short-lived primary reaction product has been recorded with adiabatic and vertical ionization energies of (7.84±0.02) and (8.18±0.02) eV respectively. An average vibrational separation of (680±30) cm–1was observed in this band. Comparison between the experimental vertical and adiabatic ionization energies and ionization energies computed for CH3CHCl (X2A) and CH2CH2Cl (X2A) at different levels of theory led to the assignment of the observed first photoelectron band to the ionization of CH3CHCl (X2A). The observed vibrational structure was assigned to excitation of the C–Cl stretching mode in CH3CHCl+(X1A).Proceedings of the 11th International Congress of Quantum Chemistry satellite meeting in honor of Jean-Louis Rivail 相似文献
10.
Monuron (C9H11ClN2O; N,N-dimethyl-N′-(4-chlorophenyl) urea, CAS 150-68-5) was synthesized and the heat capacities of the compound were measured in the temperature range from 79 to 385 K with a high precision automated adiabatic calorimeter. No phase transition or thermal anomaly was observed in this range. The enthalpy and entropy data of the compound relative to the reference temperature 298.15 K were derived based on the heat capacity data. The thermodynamic properties of the compound were further investigated through DSC and TG analysis. The melting point, the molar enthalpy, and entropy of fusion were determined to be 447.6±0.1 K, 29.3±0.2 kJ mol−1, and 65.4 J K−1 mol−1, respectively. 相似文献