15N Isotopic Effects on the Raman Spectra of Tribromoacetamide

Abstract

¹⁵N-Tribromoacetamide has been synthesized with an isotopic content of 99, 4%, its Raman spectra have been recorded in the range 4.000–50 cm^?1. The isotopic shifts arising from ¹⁵N have been determined and interpreted. We have assigned the vibrational spectra of Br₃CCONH₂ and some overtones, combinations and difference bands. The molecular structure of tribromoacetamide has been studied employing the Ab Initio teoretical calculations and the Teller - Redlich isotopic product rule has been applied by assuming these geometrical parameters:

rCN = 1.4623 Å, rCC = 1.6014 Å, rBrC = 1.9468 Å, rCO = 1.2144 Å, rNH = 1.0292 Å, C-C-Br = 108.83320, C-C-0:118.2440, C-C-N:120.4137, C-N-H:110.45930     

Topology optimization of composite hyperelastic material using SPIMFO-method

Meccanica - Fiber reinforced materials are used in assorted engineering application and for this reason, new additive manufacturing technologies have been developed for this type of materials. With...     

Local boundedness of the number of solutions of Plateau’s problem for polygonal boundary curves

In the present article, the author proves two generalizations of his “finiteness-result” (I.H.P. Anal. Non-lineaire, 2006, accepted) which states for any extreme simple closed polygon that every immersed, stable disc-type minimal surface spanning Γ is an isolated point of the set of all disc-type minimal surfaces spanning Γ w.r.t. the C ⁰-topology. First, it is proved that this statement holds true for any simple closed polygon in , provided it bounds only minimal surfaces without boundary branch points. Also requiring that the interior angles at the vertices of such a polygon Γ have to be different from the author proves the existence of some neighborhood O of Γ in and of some integer , depending only on Γ, such that the number of immersed, stable disc-type minimal surfaces spanning any simple closed polygon contained in O, with the same number of vertices as Γ, is bounded by .      

On the Road Map of Vogel’s Plane

We define “population” of Vogel’s plane as points for which universal character of adjoint representation is regular in the finite plane of its argument. It is shown that they are given exactly by all solutions of seven Diophantine equations of third order on three variables. We find all their solutions: classical series of simple Lie algebras (including an “odd symplectic” one), \({D_{2,1,\lambda}}\) superalgebra, the line of sl(2) algebras, and a number of isolated solutions, including exceptional simple Lie algebras. One of these Diophantine equations, namely \({knm=4k+4n+2m+12,}\) contains all simple Lie algebras, except so\({(2N+1).}\) Among isolated solutions are, besides exceptional simple Lie algebras, so called \({\mathfrak{e}_{7\frac{1}{2}}}\) algebra and also two other similar unidentified objects with positive dimensions. In addition, there are 47 isolated solutions in “unphysical semiplane” with negative dimensions. Isolated solutions mainly belong to the few lines in Vogel plane, including some rows of Freudenthal magic square. Universal dimension formulae have an integer values on all these solutions at least for first three symmetric powers of adjoint representation.     

Efficient evaluation of the algebrants of VB wave functions using the successive expansion method. I. Spin S = 0, ½

An efficient expansion method for the evaluation of VB matrix elements is introduced. The overlaps of VB wave functions of N electrons can be treated as algebrants, i.e., generalized determinants, of N × N matrices. An algebrant can be expanded with subalgebrants of lower orders in a successive way. By choosing Rumer spin bases and appropriately arranging the expansion, it is found that the number of unique subalgebrants involved in the expansion increases in a quite moderate way with N. In contrast to the traditional symmetric group approach, which explicitly utilizes all N! representation matrices, the new strategy incorporates the group theoretical factors in a simple way in the successive expansion. As only the unique subalgebrants are further expanded, the computational effort required by the new strategy scales in a very acceptable manner with the increasing number of electrons. © 1997 John Wiley & Sons, Inc. Int J Quant Chem 62: 245–259, 1997     

Influence of ultrasound on nanostructural iron formed by electrochemical reduction

A method for control of particle dimensions of nanostructural amorphous iron powder obtained by electrochemical reduction under the effect of ultrasonic oscillations in reaction medium is described in this paper. Depending on the character of ultrasonic oscillations nanostructural powders were obtained differing both in average dimension and distribution of particle dimensions. In the case of simultaneous sonocation using ultrasonic vibrations with frequencies differing from each other by a factor of ten (20 and 200 kHz), the effect is complex, but includes narrowing of the average particle dimension.