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91.
Igor V. Zatovsky Nataliya Yu. Strutynska Nikolay S. Slobodyanik Oleg V. Shishkin 《Journal of solid state chemistry》2011,184(3):705-711
The crystallization of complex phosphates from the melts of Cs2O-P2O5-CaO-MIII2O3 (MIII—Al, Fe, Cr) systems have been investigated at fixed value Cs/P molar ratios equal to 0.7, 1.0 and 1.3 and Са/Р=0.2 and Ca/МIII=1. The fields of crystallization of CsCaP3O9, β-Ca2P2O7, Cs2CaP2O7, Cs3CaFe(P2O7)2, Ca9MIII(PO4)7 (MIII—Fe, Cr), Cs0.63Ca9.63Fe0.37(PO4)7 and CsCa10(PO4)7 were determined. Obtained phosphates were investigated using powder X-ray diffraction and FTIR spectroscopy. Novel whitlockite-related phases CsCa10(PO4)7 and Cs0.63Ca9.63Fe0.37(PO4)7 have been characterized by single crystal X-ray diffraction: space group R3c, a=10.5536(5) and 10.5221(4) Å, с=37.2283(19) and 37.2405(17) Å, respectively. 相似文献
92.
Ji Z Li Y Pritchett TM Makarov NS Haley JE Li Z Drobizhev M Rebane A Sun W 《Chemistry (Weinheim an der Bergstrasse, Germany)》2011,17(8):2479-2491
The synthesis, one-photon photophysics and two-photon absorption (2PA) of three dipolar D-π-A 4-[9,9-di(2-ethylhexyl)-7-diphenylaminofluoren-2-yl]-2,2':6',2'-terpyridine and their platinum chloride complexes with different linkers between the donor and acceptor are reported. All ligands exhibit (1)π,π* transition in the UV and (1)π,π*/(1)ICT (intramolecular charge transfer) transition in the visible regions, while the complexes display a lower-energy (1)π,π*/(1)CT (charge transfer) transition in the visible region in addition to the high-energy (1)π,π* transitions. All ligands and the complexes are emissive at room temperature and 77 K, with the emitting excited state assigned as the mixed (1)π,π* and (1)CT states at RT. Transient absorption from the ligands and the complexes were observed. 2PA was investigated for all ligands and complexes. The two-photon absorption cross-sections (σ(2)) of the complexes (600-2000 GM) measured by Z-scan experiment are much larger than those of their corresponding ligands measured by the two-photon induced fluorescence method. The ligand and the complex with the ethynylene linker show much stronger 2PA than those with the vinylene linker. 相似文献
93.
94.
Flores JA Andino JG Tsvetkov NP Pink M Wolfe RJ Head AR Lichtenberger DL Massa J Caulton KG 《Inorganic chemistry》2011,50(17):8121-8131
The ligand class 2,2'-pyridylpyrrolide is surveyed, both for its structural features and its electronic structure, when attached to monovalent K, Cu, Ag, Au, and Rh. The influence of pyrrolide ring substituents is studied, as well as the question of push/pull interaction between the pyridyl and pyrrolide halves. The π donor ability of the pyrrolide is found to be less than that of an analogous phenyl. However, in contrast to the phenyl analog, the HOMO is pyrrolide π in character for pyridylpyrrolide complexes of copper and rhodium, while it is conventionally metal localized for planar, d(8) rhodium pyridylphenyl. Monovalent three-coordinate copper complexes show great deviations from Y-shaped toward T-shaped structures, including cases where the pyridyl ligand bonds only weakly. 相似文献
95.
Rebane A Drobizhev M Makarov NS Beuerman E Haley JE Krein DM Burke AR Flikkema JL Cooper TM 《The journal of physical chemistry. A》2011,115(17):4255-4262
We investigate two-photon absorption (2PA) in a series of fluorenyl-based 9,9-diethyl-2-ethynyl-7-((4-R-phenyl)ethynyl)-9,9a-dihydro-4aH-fluorene chromophores with R being various electron donating (ED) and electron withdrawing (EW) groups. We use wavelength-tunable femtosecond laser pulses to measure the 2PA cross sections in the lowest dipole-allowed transition and show that the substituents with stronger ED or EW character enhance the peak 2PA cross section (up to σ(2) ~ 60-80 GM) while the neutral substituents lead to smaller cross sections, σ(2) < 10 GM. We apply two-level approximation to establish a quantitative relation between the 2PA in the pure electronic transition (0-0) and the corresponding change of the permanent electric dipole moment upon the excitation (Δμ). This relation is elucidated by comparing Δμ values obtained from the 2PA measurements with quantum-chemical calculations and with measurements of solvatochromic shifts in a series of solvents. We show that the calculated Δμ correlate well with the values obtained from the 2PA spectroscopy. The Δμ values obtained from the solvatochromic shifts agree well with the above two methods for the chromophores with neutral or weak EW or ED substituents. On the other hand, stronger EW or ED end groups give much larger Stokes shifts, which lead to an overestimation of the Δμ values. We tentatively attribute this effect to the excitation-induced electronic density change occurring predominantly at the substituent side of the molecule, which causes the effective point dipole associated with the Δμ to interact more strongly with the surrounding solvent. 相似文献
96.
97.
98.
The hyperfine lines of the forbidden Γ34?→?Γ34 optical transition are observed in the axially polarized absorption spectra of Ho3+ in LiYF4. They are explained by an admixture of nearby lying Γ2 and Γ1 crystal field states by the perpendicular part of the magnetic dipole hyperfine interaction. 相似文献
99.
Nikolay V. Shemetov 《Annali di Matematica Pura ed Applicata》1995,168(1):301-316
Summary
The aim of this paper is to study a phase transition model, based on the Cattaneo-Fourier constitutive law for the heat flux and on a relaxed constitutive law for the phase variable. In turn, the model describes fast processes of melting and crystallization with supercooling and superheating effects. We give existence and stability results for the former phase transition problem. Uniqueness is deduced from the stability result
On leave from: Lavrent'ev Institute of Hydrodynamics, 630090 Novosibirsk, Academy of Sciences of Russia, Russia. 相似文献
100.
Asymmetric simple exclusion processes are important for understanding low-dimensional multi-particle dynamic phenomena. The effect of irreversible detachments of particles on dynamics of asymmetric simple exclusion processes is studied using analytical and computer simulation techniques. In the simplest model, where particles can only detach from a single site in the bulk of the system, a theory is presented and used to calculate explicitly phase diagrams and particle density profiles. The complexity of the phase behavior is discussed in terms of a recent domain-wall theory for driven lattice systems. The theoretical results qualitatively and quantitatively agree with computer Monte Carlo simulations. 相似文献