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51.
52.
In this paper the effective mass approximation and the k·p multi-band models, describing quantum evolution of electrons in
a crystal lattice, are discussed. Electrons are assumed to move in both a periodic potential and a macroscopic one. The typical
period e{\epsilon} of the periodic potential is assumed to be very small, while the macroscopic potential acts on a much bigger length scale.
Such homogenization asymptotic is investigated by using the envelope-function decomposition of the electron wave function.
If the external potential is smooth enough, the k·p and effective mass models, well known in solid-state physics, are proved
to be close (in the strong sense) to the exact dynamics. Moreover, the position density of the electrons is proved to converge
weakly to its effective mass approximation. 相似文献
53.
F
A1:Ag+ color center at the low coordination (100) and (110) surface sites of KCl and KBr thin films play an important role in providing
tunable laser oscillation and adsorbatesubstrate interactions. Double-well potentials at this site are investigated using
ab initio molecular electronic structure calculations. The calculated Stokes shifted (optical transition bands), opticaloptical
conversion efficiencies, the probability of orientational destruction, exciton (energy) transfer and Glasner-Tompkins empirical
rule suggest that laser light generation is sensitive to (i) the lattice anion, (ii) the coordination number of surface ions,
and (iii) the choice of the basis set centered on the anion vacancy. The adsorbate-substrate interactions were found to be
dependent on the electronegativity of the adatom and on the lattice anion. Optimised geometries and the coadsorption of CO
and (F, Cl, Br, I) on KCl and KBr (100) crystals are presented. Calculated chemisorption energies for CO on the (halogen atom/defect
free sites of KCl and KBr (100) crystals) showed that the coadsorption of halogen atom tends to block other adsorbate-substrate
interactions at the nearest neighbour sites. Thus if halogen atom coverage increases, the CO prefers to be adsorbed on the
K+ site of the KCl and KBr (100) surfaces and on KBr relative to KCl.
相似文献
54.
We describe a protocol for distilling maximally entangled bipartite states between random pairs of parties from those sharing a tripartite W state |W=(1/sqrt[3])(|100+|010+|001)(ABC), and show that the total distillation rate E(t)(infinity) [the total number of Einstein-Podolsky-Rosen (EPR) pairs distilled per W, irrespective of who shares them] may be done at a higher rate than EPR distillation between specified pairs of parties. Specifically, the optimal rate for distillation to specified parties has been previously shown to be 0.92 EPR pairs per W, while our protocol can asymptotically distill 1 EPR pair per W between random pairs of parties, which we conjecture to be optimal. We thus demonstrate a tradeoff between overall distillation rate and final distribution of EPR pairs. We further show that there exist states with fixed lower-bounded E(t)(infinity), but arbitrarily small distillable entanglement for specified parties. 相似文献
55.
The Maxwell-Wagner-Sillars (MWS) relaxation is studied for semi-crystalline polymers poly (ether ether ketone) (PEEK), in the range 20 Hz-1 MHz and temperature varying from 80 to 330 °C. The parameter is the crystallization condition in the case of PEEK, which is a semi-crystalline polymer considered as a particulate composite. The relaxation found in the semi-crystalline polymers above the α relaxation of the PEEK is ascribed to the trapping of conductive carriers at the interface between crystalline lamellae and the amorphous matrix. The study of PEEK microstructure is based on differential calorimetry and X-rays diffraction. Two lamellae populations have been detected, that depends on the crystallization temperature and its duration. The crystallinity rate is increasing with crystallization temperature and duration. In dielectric studies, the use of the electric modulus instead of permittivity allows us to minimize the ionic conduction and then leads to the appearance of the interfacial relaxation. According to our measurements, the crystallinity rate is not the main factor of the interfacial relaxation intensity, which also depends on the nature and degree of perfection of the lamellae. 相似文献
56.
Analysis Mathematica - We introduce and study the k-Hankel Gabor transform. We investigate the localization operators for this transform. In particular, we study their trace class properties and we... 相似文献
57.
58.
Ben Ali K Lafon O Zimmermann H Guittet E Lesot P 《Journal of magnetic resonance (San Diego, Calif. : 1997)》2007,187(2):205-215
We describe several homo- and heteronuclear 2D NMR strategies dedicated to the analysis of anisotropic (2)H spectra of a mixture of dideuterated unlike/like stereoisomers with two remote stereogenic centers, using weakly orienting chiral liquid crystals. To this end, we propose various 2D correlation experiments, denoted "D(H)(n)D" or "D(H)(n)C" (with n=1, 2), that involve two heteronuclear polarization transfers of INEPT-type with one or two proton relays. The analytical expressions of correlation signals for four pulse sequences reported here were calculated using the product-operators formalism for spin I=1 and S=1/2. The features and advantages of each scheme are presented and discussed. The efficiency of these 2D sequences is illustrated using various deuterated model molecules, dissolved in organic solutions of polypeptides made of poly-gamma-benzyl-L-glutamate (PBLG) or poly-epsilon-carbobenzyloxy-L-lysine (PCBLL) and NMR numerical simulations. 相似文献
59.
A clustering method has been developed to group signals that display similar dynamic behavior. The procedure involves using the method of time delay embedding to construct a trajectory in state space from a time series. Certain features that characterize the geometry of the trajectory have been defined. These features were subjected to a series of statistical tests to determine their usefulness in a hierarchical clustering analysis. The latter is aimed at finding groups of similar trajectories. The trajectory-based clustering algorithm has been applied to simulated data, which included both stochastic data generated by a linear AR model, and nonlinear data generated by a Duffing oscillator. The results show that the algorithm works reliably in both cases. 相似文献
60.
本文报道了Ln7O6(BO3)(PO4)2:Eu(Ln=La,Gd,Y)在UVU-UV区的激发光谱及Eu^3 在可见区的发射光谱,其激发光谱包括基质在真空紫外区的激发带和激活剂离子在紫外区的Eu^3 -O^2-电荷迁移带,随着La^3 ,Gd^3 ,Y^3 离子半径逐渐减小,Eu^3 -O^2-电荷迁移带的重心位置逐渐向高能量方向移动,Gd7O6(BO3)(PO4)2:Eu和Y7O6(BO3)(PO4)2:Eu在真空紫外区的吸收与Eu^3 -O^2-电荷迁移带位于紫外区的吸收的比值要高于在La7O6(BO3)(PO4)2:Eu中的这个比值,激发能可被基质吸收,传递给激活剂离子,得到Eu^3 的红光发射,在Gd7O6(BO3)(PO4)2:Eu中,^5D0→^7F1的发射强度较强,在Y7O6(BO3)(PO4)2:Eu中,^5D0→^7F2和^5D0→^7F3的跃迁较强。 相似文献