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Marc Chardin Kamran Divaani-Aazar 《Proceedings of the American Mathematical Society》2008,136(8):2749-2754
We prove a duality theorem for graded algebras over a field that implies several known duality results: graded local duality, versions of Serre duality for local cohomology and of Suzuki duality for generalized local cohomology, and Herzog-Rahimi bigraded duality.
24.
Shahid Imran Muhammad Hussain Muhammad Kamran Siddiqui Muhammad Numan 《Journal of mathematical chemistry》2017,55(3):849-863
The discovery of the fullerene molecules and related forms of carbon such as nanotubes has generated an explosion of activity in chemistry, physics, and materials science. Classical fullerene is an all-carbon molecule in which the atoms are arranged on a pseudospherical framework made up entirely of pentagons and hexagons. A toroidal fullerene (toroidal polyhex) is a cubic bipartite graph embedded on the torus such that each face is a hexagon. In this paper we examine the existence of entire labeling, where face-weights of all 6-sided faces of disjoint union of toroidal fullerenes form an arithmetic progression with common difference \(\hbox {d}\in \{1,2,3\}\). 相似文献
25.
We explicitly compute the Green’s function of the spinor Klein–Gordon equation on the Riemannian and Lorentzian manifolds of the form M0×?×MN, with each factor being a space of constant sectional curvature. Our approach is based on an extension of the method of spherical means to the case of spinor fields and on the use of Riesz distributions. 相似文献
26.
Prof. Dr. Skye Fortier José Veleta Dr. Amélie Pialat Jennifer Le Roy Kamran B. Ghiassi Prof. Dr. Marilyn M. Olmstead Dr. Alejandro Metta‐Magaña Prof. Dr. Muralee Murugesu Prof. Dr. Dino Villagrán 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(6):1931-1936
After more than 50 years, the synthesis and electronic structure of the first and only reported “U0 complex” [U(bipy)4] ( 1 ) has been reinvestigated. Additionally, its one‐electron reduced product [Na(THF)6][U(bipy)4] ( 2 ) has been newly discovered. High resolution crystallographic analyses combined with magnetic and computational data show that 1 and its derivative 2 are best described as highly reduced species containing mid‐to‐high‐valent uranium ligated by redox non‐innocent ligands. 相似文献
27.
Hamid Ait Abderrahmane Kamran Siddiqui Georgios H. Vatistas 《Experiments in fluids》2011,50(3):677-688
The rotating waves within a hollow vortex core (polygonal patterns) are generated under shallow water conditions inside a
cylindrical tank by a revolving disk at its bottom. We previously reported some basic features of these polygonal patterns
during transition and at the equilibrium states. The present paper includes a more comprehensive investigation into the transition
process of these polygonal patterns and expands the recent partial results that have been previously reported. We show that
the parent wave (or the N-gon pattern) to disk frequencies ratio is around one-third (1/3) regardless of the flow conditions. A detailed insight into the transition process from the parent wave N-gon to daughter wave (N + 1)-gon is provided, which consists of two regimes, quasi-periodic and synchronized. Based on these observations, we explained the
shrinking of the disk speed subintervals over which the N-gon patterns occur, when N increases. 相似文献
28.
While diffuse optical tomography (DOT) has been studied for years, bioluminescence tomography (BLT) is emerging as a promising optical molecular imaging tool. These two modalities have different goals. DOT is for reconstruction of optical parameters of a medium such as a breast from surface measurements induced by external sources. BLT is for reconstruction of a bioluminescent source distribution in a medium such as a mouse from surface measurements induced by internal bioluminescent sources. However, an important pre-requisite for BLT reconstruction is the knowledge on the distribution of optical parameters within the medium, which is the output of DOT. In this paper, we propose a mathematical model integrating BLT and DOT at the fundamental level; that is, performing the two types of reconstructions simultaneously instead of doing them sequentially. The model is introduced through minimizing the difference between predicted quantities and boundary measurements, as well as incorporating regularization terms. Then, we show the solution existence, introduce numerical schemes and prove convergence of the numerical solution. We also present numerical results to illustrate the utility of our approach. 相似文献
29.
Inside Back Cover: Isolation of CeLu2N@Ih‐C80 through a Non‐Chromatographic,Two‐Step Chemical Process and Crystallographic Characterization of the Pyramidalized CeLu2N within the Icosahedral Cage (Chem. Eur. J. 29/2015) 下载免费PDF全文
30.
Rajat Kumar Pal Kamran Haider Divya Kaur William Flynn Junchao Xia Ronald M Levy Tetiana Taran Lauren Wickstrom Tom Kurtzman Emilio Gallicchio 《Journal of computer-aided molecular design》2017,31(1):29-44
As part of the SAMPL5 blinded experiment, we computed the absolute binding free energies of 22 host–guest complexes employing a novel approach based on the BEDAM single-decoupling alchemical free energy protocol with parallel replica exchange conformational sampling and the AGBNP2 implicit solvation model specifically customized to treat the effect of water displacement as modeled by the Hydration Site Analysis method with explicit solvation. Initial predictions were affected by the lack of treatment of ionic charge screening, which is very significant for these highly charged hosts, and resulted in poor relative ranking of negatively versus positively charged guests. Binding free energies obtained with Debye–Hückel treatment of salt effects were in good agreement with experimental measurements. Water displacement effects contributed favorably and very significantly to the observed binding affinities; without it, the modeling predictions would have grossly underestimated binding. The work validates the implicit/explicit solvation approach employed here and it shows that comprehensive physical models can be effective at predicting binding affinities of molecular complexes requiring accurate treatment of conformational dynamics and hydration. 相似文献