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Fermi and kinetic energy are usually calculated in periodic boundary conditions model, which is not self-consistent for low-dimensional problems, where particles are confined. Thus for confined particles the potential box model was used self-consistently to calculate Fermi and kinetic energies in 3-, 2-, and 1-dimensional cases. This approach is much more logical and self-consistent. Then the conditions for neglecting dimensions, that is conditions under which the movement of particles in the box could be considered as 2- and 1- dimensional, were derived.
We study numerically the cluster structure of random ensembles of two NP-hard optimization problems originating in computational complexity, the vertex-cover problem and the number partitioning problem. We use branch-and-bound type algorithms to obta
We report macroscopic magnetic measurements carried out in order to detect and characterize field-induced quantum entanglement in low dimensional spin systems. We analyze the pyroborate MgMnB_2O_5 and the and the warwickite MgTiOBO_3, systems with sp
Sampling equilibrium ensembles of dense polymer mixtures is a paradigmatically hard problem in computational physics, even in lattice-based models. Here, we develop a formalism based on interacting binary tensors that allows for tackling this problem
Layered Li(Ni,Mn,Co,)O$_2$ (NMC) presents an intriguing ternary alloy design space for optimization as a cathode material in Li-ion batteries. Recently, the high cost and resource limitations of Co have added a new design constraint and high Ni-conta
We report results of MD simulations of amorphous ice in the pressure range 0 - 22.5 kbar. The high-density amorphous ice (HDA) prepared by compression of Ih ice at T = 80 K is annealed to T = 170 K at intermediate pressures in order to generate relax