Selective spatial localization of the atom displacements in one-dimensional hybrid quasi-regular (Thue–Morse and Rudin–Shapiro)/periodic structures
Introduction
After the discovery of the quasicrystals [1], [2], [3] quasi-regular structures have been intensively studied. These structures do not appear in the nature, but can be produced in the laboratory as multilayer systems [4], [5], [6], [7] by molecular beam epitaxy (MBE) techniques. The interest on these systems was increased after the predictions that they would exhibit peculiar electron and phonon critical states and highly fragmented fractal energy spectra [8], [9], [10], [11], [12], [13], [14], [15]. Many works have been devoted to the study of the basic properties of quasi-regular structures, as it can be seen in [16], [17]. These systems can be characterized by the presence of two different orders at different length scales. The periodic order of the crystalline arrangement of atoms in each layer is present at the atomic level, whereas the quasi-regular order due to the disposition of the different atomic layers following a given building sequence is the main feature at the long scale. This order is artificially produced during the growth process and is carefully controlled. Because the relevant physical scales influence different physical phenomena it is possible, in principle, to exploit the quasi-regular order introduced in the system by tuning the corresponding length scales, thus opening new possible applications. The peculiar characteristics of these systems come from the interplay of these two different orders. Aspects of the role of this quasi-regular or aperiodic order in science and technology can be found in a recent review [18].
These systems present some additional physical characteristics or better performances than the periodic structures for specific applications. This has been realized in the optical capabilities of quasi-regular systems concerning second- [19] and third-harmonic generation [20], as well as the localization of light in these systems [21], [22]. Hybrid-order devices formed by periodic and Fibonacci quasi-regular blocks have been found to exhibit complementary optical responses [23]. Perfect optical transmission has been found in symmetric Fibonacci-class multilayers [24], [25]. Broad omnidirectional reflection bands have been predicted when combining Fibonacci sequences and periodic 1D photonic crystals [26].
The vibrational spectrum of quasi-regular structures presents a highly fragmented character [12], [15], [27]. By using different materials as the starting ones we can have different realizations (ABAAB…, BABBA…, etc.), and thus we can have systems with primary and secondary gaps in different frequency ranges. By combining these systems with finite periodic structures it could be possible to further modify the frequency spectrum, and perhaps the vibrational properties of the resulting system as compared to those of the constituent quasi-regular and periodic systems. These are the structures to be studied here. They can be considered as a more complicated variation of the systems used in phonon cavities [28], [29], [30], where a spacer layer is sandwiched between two finite superlattices. It remains to be seen if these hybrid systems possess equivalent properties. In order to describe the properties of real quasi-regular systems it is necessary to describe these structures with enough physical realism in spite of the simplicity of the models.
We shall maintain in our study the basic simplicity employed in the big majority of calculations [16], thus employing 1D linear chains while keeping all the basic physical ingredients in the model. The Fibonacci systems are the most studied ones because they can serve as 1D realizations of the quasicrystals [1], [2], [3]. Instead we shall consider here those systems obtained by means of the Thue–Morse [31] and Rudin–Shapiro [32] sequences, that are less frequently considered. In particular Rudin–Shapiro sequences exhibit peculiar characteristics and are not covered by the theorems valid for other quasi-regular sequences [13].
The theoretical model and method of calculation are presented in Section 2. Section 3 deals with the results for the Thue–Morse and Section 4 with those of the Rudin–Shapiro systems. Conclusions are presented in Section 5.
Section snippets
Theoretical model and method of calculation
We shall consider systems formed by combining a quasi-regular sequence, let us say a Thue–Morse one ABBABAAB, and a periodic one ABABAB. We shall use the simplest model enabling us to get the essential physical data. Thus we shall consider 1D linear chains with nearest neighbor interactions. In spite of its simplicity this kind of model has been applied to the study of the properties of real materials with good results: theoretical analysis of Raman spectra of ultrathin Si–Ge superlattices [33]
Thue–Morse systems
The Thue–Morse systems are produced by stacking recursively with two generator blocks A and B via the substitution rule [31]thus producing the following sequence:In Fig. 1a, we present the frequency spectrum versus the order number for a periodic system formed by the repetition of the AB blocks 64 times. Fig. 1b presents this information for a seventh-order Thue–Morse generation (composed of 256 A atoms and 192 B atoms). Fig. 1c presents the
Rudin–Shapiro systems
The Rudin–Shapiro systems are formed by the recursive stacking along the x3-direction with four generators, blocks A, B, C and D, mapping the mathematical rule in the Rudin–Shapiro sequence, which is obtained from the letters A, B, C, D via the following substitution rules [32]:thus giving the following sequence:The number of terms in the sequence goes as 2n, n being the generation order, as in the Thue–Morse case. The A and B blocks
Conclusions
We have studied the vibrational frequencies and atom displacements of structures formed by sandwiched periodic-quasi-regular-periodic, or quasi-regular-periodic-quasiregular 1D heterostructures. The quasi-regular systems obey the Thue–Morse or Rudin–Shapiro sequences. We have seen in all the cases modifications in the frequency spectrum specially in the primary and secondary gaps. These modifications are not reflected, in a substantial way, in properties involving the whole frequency spectrum,
Acknowledgement
This work has been partially supported by the Ministerio de Educación y Ciencia (Spain) through Grant MAT2003-04278.
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