The lattice deformation and the energy of antiphase boundaries in Fe-Si alloys

The lattice deformation across the antiphase boundary and the energy of both types (a/2111 anda(100) of antiphase boundaries lying in {110} plane are calculated using a series of three interatomic potentials fitted to experimental data. It is shown that the relaxation of atomic planes in the vicinity of antiphase boundary is important for thea/2111 antiphase boundary and is negligible for a 100 antiphase boundary in the DO₃ structure.The author is grateful to Dr. F.Kroupa and to Dr. A.Gemperle for valuable discussions.     

Collisionless kinetic equations for massive particles with spins 1/2 and 0 in gravitational and electromagnetic fields

We define a covariant and gauge-invariant generalization of the Wigner functions of particles with spins 1/2 and 0. The collisionless kinetic equations are obtained for these particles in external gravitational and electromagnetic fields in the quasiclassical approximation; also obtained are the momentum representations of the energy-momentum tensor, current, and spin tensor, taking into account the effects of the spin's interaction with the gravitational field an electromagnetic field. The following notation is used: e and m are the charge and mass of the particles; is Planck's constant; (x) are the covariant-fixed Dirac matrices; ^,=(1/4)[, ]: a(^b)=(1/2) (a b +ab ); [A, B]=A·B – B·A; A,B=A·B+B·A; g(x)=det(g (x));R = –...; the speed of light c=1.Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 9, pp. 47–53, September, 1990.The author wishes the thank Yu. G. Ignat'ev and members of the seminar in General Relativistic Statistics and Cosmology of the Kazan' Pedagogical Institute for useful discussions.     

Energy and momentum in general relativity

In general relativity, conservation of energy and momentum is expressed by an equation of the form /x= 0, where –gT represents the total energy, momentum, and stress. This equation arises from the divergence formula dV _v = (/x ^v )d ⁴ d. Here we show that this formula fails to account properly for the system of basis vectors e(x). We obtain the (invariant) divergence formula e dV _v = e (/x ^v + )d ⁴ d. Conservation of energy and momentum is therefore expressed by the covariant equation (/x ^v ) + = 0. We go on to calculate the variation of the action under uniform displacements in space-time. This calculation yields the covariant equation of conservation, as well as the fully symmetric energy tensor . Finally, we discuss the transfer of energy and momentum, within the context of Einstein's theory of gravitation.     

Fock representations of the affine Lie algebraA 1 (1)

The aim of this note is to show that the affine Lie algebraA ₁ ⁽¹⁾ has a natural family _, ,v of Fock representations on the spaceC[x _i,y _j;i andj ], parametrized by (,v) C ². By corresponding the highest weight _, of _, to each (,), the parameter spaceC ₂ forms a double cover of the weight spaceC₀C –₁ with singularities at linear forms of level –2; this number is (–1)-times the dual Coxeter number. Our results contain explicit realizations of irreducible non-integrable highest wieghtA ₁ ⁽¹⁾ -modules for generic (,v).     

A resistometric investigation of the decomposition kinetics of Al-21·8 at.% Zn solid solution at 276 °C

Under the condition of nearly equilibrium concentration of vacancies, time dependence of the amount of isothermal transformation given byy=R/R _f was investigated whereR _f is the total structural change of resistivity on completion of the whole process andR is the measured resistivity change. The investigation was done on the 21·8 at.% (40·3wt.%) Zn alloy under the condition of relatively low supersaturation of a few degrees centigrade below the metastable _R solvus line. The total transformation involves four kinetic stages: the first two stages correspond probably to diffusion-controlled growth of the _R particles from the supersaturated solid solution and to the ripening of these particles till their conversion to the cubic phase takes place. The last two kinetic stages account analogously for the particles growth and ripening. Both _R and phases were identified by the transmission electron microscopy. When separating the individual stages, the approximation byy=1–exp [–(mt) ⁿ] of the amount of transformationy was used. The approximation allowed to get the starting values of both the time and the change of the structural part of the electrical resistance for individual stages and also to derive the parametersm _i, n_i which had to be redetermined for the individual separated stages. These data made it possible to synthetize the experimental curves ofR andy vs. time for the total transformation.It is a pleasure to thank Doc. Dr. V.Syneek CSc. for stimulating the author's interest in this problem and for providing helpful discussions. I also would like to express my thanks to Ing. P.Bartuka CSc. for the transmission electron microscopic study carried out to identify the particular phases. The author is indebted to Ing.V. íma for the preparation of the investigated alloy and to Mrs. A.Mendlová and Mr. P.Vyhlídka for technical assistance.     

Static and Vibrational Properties of Transition Metals

A model pseudopotential depending on an effective core radius but otherwise parameter free is proposed to study the equation of state by incorporating the s-d hybridization effects. Very recently proposed screening function due to Sarkar et al has been used to obtain the screened form factor. The equations of state for Cu, Ta, Mo, W and Pt have been studied up to the pressure of 1000 GPa. The vibrational properties such as phonon dispersion curves (in q and r space), phonon density of states, mode Grüneisen parameters, maximum frequency _max, mean frequency , ^21/2 = (/ ^-1)^1/2 and fundamental frequency ² and static properties such as dynamical elastic constants of rhodium and iridium are also calculated. The theoretical results are compared with experimental findings wherever possible. A good agreement between theoretical investigations and experimental findings has confirmed our formulation.     

The room-temperature decomposition of metastable phases precipitated in the Al-Zn alloys at 200 °C

The room-temperature decomposition of metastable phases in the Al-Zn alloys (from 25 to 50 wt. % Zn) was studied by the transmission electron microscopy and X-ray diffraction. Metastable phases, i.e. G.-P. zones, _R-and -phases, were grown at 200 °C and their decomposition into equilibrium -phase at 20 °C was investigated. Ageing times comprised 1 to 999 days.Both the decomposition mechanism and the rate of decomposition of coherent phases were found to be dependent on the particle sizes and their density reached at 200 °C. The local vacancy supersaturation around the -nucleus in a dense system of G.-P. zones leads to an enhanced growth rate of such nucleus and thus to the formation of one large -precipitate at the expense of several neighbouring G.-P. zones. The elastic stress field around this -particle promotes the further nucleation and growth of -precipitates and leads to their gradual spread throughout the matrix. The decomposition of intermediately sized _Rprecipitates results in the development of -precipitates of comparable sizes nucleated on the array of misfit dislocations at the periphery of _R-precipitates. The cooperative effect between neighbouring particles does not influence the decomposition of large _R-precipitated which split then into several smaller -particles. The rate of G.-P. zones or _R to -decomposition increases with the increasing sizes of transition precipitates and with the zinc content of the alloy. The kinetics of to -decomposition was found to be independent both on the annealing time at 200 °C and on the investigated alloy composition. This can be attributed to the constant density of misfit dislocations as nucleation sites for -precipitates along the -matrix interface and to the large mutual separation of -precipitates in all these alloys.In conclusion we would like to express our thanks to Doc. Dr. V.Syneek, CSc. for his valuable discussions and to Ing. V.íma for the preparation of Al-Zn alloys. Our thanks are also due to Mr. Z.iký for his help in the X-ray diffraction measurement and to P.Vyhlídka for the careful chemical analyses of the investigated alloys.     

Representations of an algebra of the Gell-Mann-Dashen type

LetG denote the infinitedimensional Lie algebra given by communtation relations [a _m ,a _n ] =c a _m+n (m, n=0, 1, ...), wherec are structure constants of the arbitrary centerless Lie algebra. The paper is devoted to the construction of a certain class of skewsymmetric irreducible representations (so called F-representations) of the algebraG .     

Operator product expansions on the vacuum in conformal quantum field theory in two spacetime dimensions

Let ₁(x) and ₂(y) be two local fields in a conformal quantum field theory (CQFT) in two dimensional spacetime. It is then shown that the vector-valued distribution ₁(x)₂(y)|0 is a boundary value of a vectorvalued holomorphic function which is defined on a large conformally invariant domain. By group theoretical arguments alone it is proved that ₁(x)₂(y)|0 can be expanded into conformal partial waves. These have all the properties of a global version of Wilson's operator product expansions when applied to the vacuum state |0. Finally, the corresponding calculations are carried out more explicitly in the Thirring model. Here, a complete set of local conformally covariant fields is found, which is closed under vacuum expansion of any two it its elements (a vacuum expansion is an operator product expansion applied to the vacuum).Work supported by Deutsche Forschungsgemeinschaft     

The size effect correction of d. c. resistance in metal wires

A simple method of determining the bulk value of the d.c. resistance r, of the residual resistance ratiok , and of the mean free path of electrons in isotropic metal wires is presented. For thick wires the linear correction can be applied under the condition that the experimentally found mean free path _e is smaller than the wire diameterd. In both thick and thin wires another type of correction can be used, based on the difference, between the precise and linear correction as a function of /d, carried out by a graphical method.The author acknowledges useful discussions with P.Svoboda, to whom he is indebted for stimulating remarks. Also the kind advice of L.Smrka and P.Steda was welcome.     

Feynman integral and complex classical trajectories

Let _t be an analytic solution of the Schrödinger equation with the initial condition . Let _t be the solution of the Schrödinger equation with the initial condition =, where is an analytic function. When 0, then _t (x) _t (x)¹ ( _t (x)), where _t (x) trajectory starting from x. We relate this result to Feynman's sum over trajectories and complex stochastic differential equations.     

Logically independent von Neumann lattices

Three definitions of logical independence of two von Neumann latticesP₁,P₂ of two sub-von Neumann algebras ₁, ₂ of a von Neumann algebra are given and the relations of the definitions clarified. It is shown that under weak assumptions the following notion, called logical independence is the strongest:A B 0 for any 0 A P₁, 0 B P₂. Propositions relating logical independence ofP₁,P₂ toC ^*-independence,W ^* independence, and strict locality of ₁, ₂ are presented.     

The van der Waals limit for classical systems. I. A variational principle

We consider the thermodynamic pressurep(, ) of a classical system of particles with the two-body interaction potentialq(r)+ ^v K(r), where is the number of space dimensions, is a positive parameter, and is the chemical potential. The temperature is not shown in the notation. We prove rigorously, for hard-core potentialsq(r) and for a very general class of functionsK(s), that the limit 0 of the pressurep(, ) exists and is given by where the limit and the supremum can be interchanged. Here is a certain class of nonnegative, Riemann integrable functions,D is a cube of volume |D|, anda ⁰() is the free energy density of a system withK=0 and density . A similar result is proved for the free energy.     

Quantum-Logics-Valued Measure Convergence Theorem

In this paper, the following quantum-logic valued measure convergence theorem is proved: Let (L ₁, 0, 1) be a Boolean algebra, (L ₂, , , 0, 1) be a quantum logic and { _n : n N} be a sequence of s-bounded (L ₂, , , 0, 1)-valued measures which are defined on (L ₁, 0, 1). If for each a (L ₁, 0, 1), { _n (a)} _{n N} is an order topology Cauchy sequence, when {v(a)} convergent to 0, { _n (a)} is order topology convergent to 0 for each n N, where v is a nonnegative finite additive measure which is defined on (L ₁, 0, 1), then when {v(a)} convergent to 0, { _n (a)} are order topology convergent to 0 uniformly with respect to n N.     

Rapid graphical determination of the radial intensity distribution of the small-angle scattering of X-rays from the measured data

The radially symmetrical small-angle scattering pattern (which would be obtained by the use of a direct beam having a point-like cross section) is in practice distorted, especially by the beam height. To eliminate this distortion the integration of a set of curves based on the derivative of the measured intensity distribution is required to derive the true radial intensity distribution. A rapid graphical method of plotting these curves is described and its accuracy is proved on an example. It is further shown that the radial intensity distribution can be determined in principle using the values of the measured curve instead of its derivative.

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On the Hamiltonian interpolation of near-to-the identity symplectic mappings with application to symplectic integration algorithms

We reconsider the problem of the Hamiltonian interpolation of symplectic mappings. Following Moser's scheme, we prove that for any mapping , analytic and -close to the identity, there exists an analytic autonomous Hamiltonian system, H such that its time-one mapping _H differs from by a quantity exponentially small in 1/. This result is applied, in particular, to the problem of numerical integration of Hamiltonian systems by symplectic algorithms; it turns out that, when using an analytic symplectic algorithm of orders to integrate a Hamiltonian systemK, one actually follows exactly, namely within the computer roundoff error, the trajectories of the interpolating Hamiltonian H, or equivalently of the rescaled Hamiltonian K=^-1H, which differs fromK, but turns out to be ⁵ close to it. Special attention is devoted to numerical integration for scattering problems.     

Monte Carlo study of the ising model phase transition in terms of the percolation transition of “physical clusters”

Finite squareL×L Ising lattices with ferromagnetic nearest neighbor interaction are simulated using the Swendsen-Wang cluster algorithm. Both thermal properties (internal energyU, specific heatC, magnetization |M|, susceptibility) and percolation cluster properties relating to the physical clusters, namely the Fortuin-Kasteleyn clusters (percolation probability P , percolation susceptibility _p, cluster size distributionn _l) are evaluated, paying particular attention to finite-size effects. It is shown that thermal properties can be expressed entirely in terms of cluster properties, P being identical to |M| in the thermodynamic limit, while finite-size corrections differ. In contrast, _p differs from even in the thermodynamic limit, since a fluctuation in the size of the percolating net contributes to, but not to _p. NearT _c the cluster size distribution has the scaling properties as hypothesized by earlier phenomenological theories. We also present a generalization of the Swendsen-Wang algorithm allowing one to cross over continuously to the Glauber dynamics.     

Neutron diffraction studies of the premartensitic transformation B2 → B19′ in Ti49Ni51 single crystals

We have studied structural changes in the high-temperature B2-phase in a large single crystal at temperatures near the premartensitic transformation B2 B19. We are the first to observe an extra 1/2 (110) reflection in neutron diffraction patterns taken along the [110]_B2 direction as the sample is cooled below 420 K, but still far from the martensite start temperature (M_s=180 K). This extra reflection heralds the formation of long-range order in atomic displacements with wave vectorq=(1/2±)[110]2/a. Premartensitic diffraction effects (caused by the development and correlation of lattice waves of atomic displacements with wave vectorsq ₁2/a[1/3, 1/3, 0] andq ₁2/1[1/3, 1/3] that were clearly visible in this same single crystal before the martensitic transformation B2 R, appeared at even lower temperatures with substantially lower intensities.Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 1, pp. 56–61, January, 1995.     

Radiative and nonradiative transitions to an unstable state

In this paper an expression is obtained, which enables us to treat radiative and nonradiative transitions in complex molecular systems, when the final state is unstable. Expressions are give for the matrix elements E/v and E|d/dR|v , where the stable state is described by a solution with a Morse potential, and the unstable state by a solution with a Hulthen potential. The possibility of the concrete realization of such transitions is discussed in the example of excimers.Translated from Izvestiya Vysshikh Uchebnykh Zavedenii Fizika, No. 10, pp. 70–75, October, 1974.     

Unbounded derivations and invariant states

Let be a von Neumann algebra with a cyclic and separating vector . Let =i[H, ·] be the spatial derivation implemented by a selfadjoint operatorH, such thatH=0. Let be the modular operator associated with the pair (, ). We prove the equivalence of the following three conditions:1)H is essential selfadjoint onD(), andH commutes strongly with .2) The restriction ofH toD() is essential selfadjoint onD(^1/2) equipped with the inner product(|)_#=(|)+(^1/2|^1/2), , D(^1/2).3) exp (itH) exp (–itH)= for anyt.We show by an example, that the first part of 1),H is essential selfadjoint onD(), does not imply 3). This disproves a conjecture due to Bratteli and Robinson [3].Part of this work was done while O.B. was a member of Zentrum für interdisziplinäre Forschung der Universität Bielefeld