Isolation and Crystallographic Characterization of Two,Nonisolated Pentagon Endohedral Fullerenes: Ho3N@C2(22010)-C78 and Tb3N@C2(22010)-C78

Purified samples of Ho₃N@C₂(22010)-C₇₈ and Tb₃N@C₂(22010)-C₇₈ have been isolated by two distinct processes from the rich array of fullerenes and endohedral fullerenes present in carbon soot from graphite rods doped with Ho₂O₃ or Tb₄O₇. Crystallographic analysis of the endohedral fullerenes as cocrystals with Ni(OEP) (in which OEP is the dianion of octaethylporphyrin) shows that both molecules contain the chiral C₂(22010)-C₇₈ cage. This cage does not obey the isolated pentagon rule (IPR) but has two sites where two pentagons share a common C−C bond. These pentalene units bind two of the metal ions, whereas the third metal resides near a hexagon of the cage. Inside the cages, the Ho₃N or Tb₃N unit is planar. Ho₃N@C₂(22010)-C₇₈ and Tb₃N@C₂(22010)-C₇₈ use the same cage previously found for Gd₃N@C₂(22010)-C₇₈ rather than the IPR-obeying cage found in Sc₃N@D_3h-C₇₈.     

EELS measurements of boron concentration profiles in p-a-Si and nip a-Si solar cells

The p-type Si layer in a-Si and μc-Si solar cells on foil needs to fulfil several important requirements. The layer is necessary to create the electric field that separates the photo-generated charge carriers; the doping also increases the conductivity to conduct the photocurrent to the front contact; on the other hand, the p-layer should transmit the incident light efficiently to the intrinsic absorber layer. We show that it is possible to study TEM samples prepared, for analysis of possible layer defects, by focussed ion beam milling to detect boron and carbon concentrations as low as 10²⁰ cm^-3, using core-loss EELS combined with numerical analysis. We control the band gap and activation energy of p-a-SiC by varying the B₂H₆ and CH₄ flow during deposition in the process chamber. We have found a linear relation between the activation energy of the dark conductivity E_act and the optical band gap E₀₄. Modelling shows that the optimum efficiency in nip solar cells is obtained when the p-a-SiC band gap is slightly larger than the band gap of the absorber layer. We have assessed the potential of core-loss EELS for detecting B and C concentrations as low as 10²⁰ cm^-3 in a spatially resolved manner, and of low-loss EELS as a probe of the local variations in plasmon energy.     

Smoothing nonlinear subdivision schemes by averaging

In the theory of linear subdivision algorithms, it is well-known that the regularity of a linear subdivision scheme can be elevated by one order (say, from C ^k to C ^k+1) by composing it with an averaging step (equivalently, by multiplying to the subdivision mask a(z) a (1 + z) factor. In this paper, we show that the same can be done to nonlinear subdivision schemes: by composing with it any nonlinear, smooth, 2-point averaging step, the lifted nonlinear subdivision scheme has an extra order of regularity than the original scheme. A notable application of this result shows that the classical Lane-Riesenfeld algorithm for uniform B-Spline, when extended to Riemannian manifolds based on geodesic midpoint, produces curves with the same regularity as their linear counterparts. (In particular, curvature does not obstruct the nonlinear Lane-Riesenfeld algorithm to inherit regularity from the linear algorithm.) Our main result uses the recently developed technique of differential proximity conditions.     

On free p-superalgebras

In this article we consider several aspects of algebraic combinatorics and combinatorial algebra over fields of prime characteristics. P-super-Radford theorem gives the structure of the free associative algebra over a field of prime characteristic with the new multiplication given by the super shuffle product, we show that this algebra is isomorphic to the reduced free super commutative algebra on s-regular words. We prove the elimination theorem for free partially commutative color Lie p-superalgebras and obtain a Schreier type formula for free Lie p-superalgebras using formal power series techniques.     

High Blocking Temperature of Magnetization and Giant Coercivity in the Azafullerene Tb2@C79N with a Single‐Electron Terbium–Terbium Bond

The azafullerene Tb₂@C₇₉N is found to be a single‐molecule magnet with a high 100‐s blocking temperature of magnetization of 24 K and large coercivity. Tb magnetic moments with an easy‐axis single‐ion magnetic anisotropy are strongly coupled by the unpaired spin of the single‐electron Tb?Tb bond. Relaxation of magnetization in Tb₂@C₇₉N below 15 K proceeds via quantum tunneling of magnetization with the characteristic time τ_QTM=16 462±1230 s. At higher temperature, relaxation follows the Orbach mechanism with a barrier of 757±4 K, corresponding to the excited states, in which one of the Tb spins is flipped.     

A Necessary and Sufficient Proximity Condition for Smoothness Equivalence of Nonlinear Subdivision Schemes

In the recent literature on subdivision methods for approximation of manifold-valued data, a certain “proximity condition” comparing a nonlinear subdivision scheme to a linear subdivision scheme has proved to be a key analytic tool for analyzing regularity properties of the scheme. This proximity condition is now well known to be a sufficient condition for the nonlinear scheme to inherit the regularity of the corresponding linear scheme (this is called smoothness equivalence). Necessity, however, has remained an open problem. This paper introduces a smooth compatibility condition together with a new proximity condition (the differential proximity condition). The smooth compatibility condition makes precise the relation between nonlinear and linear subdivision schemes. It is shown that under the smooth compatibility condition, the differential proximity condition is both necessary and sufficient for smoothness equivalence. It is shown that the failure of the proximity condition corresponds to the presence of resonance terms in a certain discrete dynamical system derived from the nonlinear scheme. Such resonance terms are then shown to slow down the convergence rate relative to the convergence rate of the corresponding linear scheme. Finally, a super-convergence property of nonlinear subdivision schemes is used to conclude that the slowed decay causes a breakdown of smoothness. The proof of sufficiency relies on certain properties of the Taylor expansion of nonlinear subdivision schemes, which, in addition, explain why the differential proximity condition implies the proximity conditions that appear in previous work.     

The lower central series of the free partially commutative group

This paper is devoted to the study of the lower central series of the free partially commutative groupF(A, ?) in connection with the associated free partially commutative Lie algebra. Using a convenient Magnus transformation, we show that the quotients of the lower central series ofF(A, ?) are free abelian groups and thatF(A, ?) can be fully ordered.