Artifact-free analysis of highly conducting binary gratings by using the Legendre polynomial expansion method

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1 A. Khavasi and K. Mehrany Vol. 26, No. 6/ June 2009/J. Opt. Soc. Am. A 1467 Artifact-free analysis of highly conducting binary gratings by using the Legendre polynomial expansion method Amin Khavasi and Khashayar Mehrany* Integrated Photonics Laboratory, Department of Electrical Engineering, Sharif University of Technology, P.O. Box , Tehran, Iran *Corresponding author: mehrany@sharif.edu Received February 17, 2009; revised April 27, 2009; accepted April 28, 2009; posted April 29, 2009 (Doc. ID ); published May 28, 2009 Analysis of highly conducting binary gratings in TM polarization has been problematic as the Fourier factorization fails and thus unwanted numerical artifacts appear. The Legendre polynomial expansion method (LPEM) is employed here, and the erroneous harsh variations attributed to the violation of the inverse rule validity in applying the Fourier factorization are filtered out. In this fashion, stable and artifact-free numerical results are obtained. The observed phenomenon is clearly demonstrated via several numerical examples and is explained by inspecting the transverse electromagnetic field profile Optical Society of America OCIS codes: , , , INTRODUCTION Despite the great success of Fourier-based methods and the Li factorization rule [1], unwanted numerical artifacts emerge in the analysis of highly-conducting gratings that are illuminated by TM polarized waves [2 5]. This problem has been attributed to the presence of both positive and negative permittivity values within the grating region, and consequently, to the violation of the inverse rule validity in the Fourier expansion of the permittivity profile [5]. A number of solutions have been so far suggested to overcome this particular difficulty and to eliminate unwanted numerical artifacts. Two different approaches have been proposed by Popov et al. in [2]. First, the block matrices appearing in the governing set of differential equations are truncated in two steps, and an additional truncation is performed to eliminate the more erroneous elements lying at the extremities of the matrices. This approach cannot however guarantee the elimination of all numerical artifacts [2]. Second, a lossier material is introduced within the bulk of the highly conducting regions. Inasmuch as the incident wave does not penetrate deeply into the highly conducting bulk and is strongly reflected from the grating surface, the introduced perturbation does not significantly alter the diffractive properties, yet it does improve the numerical behavior. Despite being quite general, the second method fails to calculate the diffraction efficiency of lossless metallic gratings precisely. This latter technique was later improved by Watanabe in [3], where an extrapolation technique is applied to further adjust the sought-after diffraction efficiency. More recently, Lyndin et al. employed a modal approach to delve into the source of the problem and successfully traced it to the presence of high-order spurious modes engendered by the unwanted yet inevitable truncation of the Fourier series [4]. They therefore proposed an astute algorithm to filter out the troublesome spurious modes whose interference with each other had caused the observed artifacts. It was also shown that the high-order nature of spurious modes, i.e., their being at the end of the modal spectrum, makes them less significant. This point was independently demonstrated in [5], where the error of using the inverse rule in Fourier factorization was studied to show that unwanted numerical artifacts can be subdued by increasing the total number of retained space harmonics. The described difficulty, however, remains a critical issue and seems to be an unwanted yet inherent flaw of all the Fourier- based methods that use Fourier expansion of permittivity profile and electromagnetic field. However, application of the nonmodal Fourier-based approach, e.g., the Legendre polynomial expansion method (LPEM) [6,7], to a lossless metallic binary grating has been found to result in stable solutions and, surprisingly, filtering out of the unwanted numerical artifacts. This unexpected phenomenon is here numerically demonstrated and is then explained by studying the electromagnetic field profile inside the grating region. It is also shown that this method can become time-consuming and memory-hungry when applied to thick lossless metallic gratings. It does not however require extra management of spurious modes lying behind the numerical artifacts. This paper is organized as follows. In Section 2, several numerical examples are provided to demonstrate that applying the LPEM can in fact eliminate numerical artifacts. The observed results are then verified by inspecting electromagnetic field profiles. The time and memory con /09/ /$ Optical Society of America

2 1468 J. Opt. Soc. Am. A/ Vol. 26, No. 6/ June 2009 A. Khavasi and K. Mehrany straints in applying the LPEM for thick highly conducting gratings are also explained. Finally, conclusions are made in Section ELIMINATION OF NUMERICAL ARTIFACTS The structure studied here is a typical surface relief binary grating. The grating parameters, as depicted in Fig. 1, are set in accordance with the example already examined in the literature: d= G =500 nm, n c =1, and n s = 10j. This structure is then illuminated by a TM polarized plane wave (the H field is parallel to the y axis) whose vacuum wavelength is =632.8 nm, and which is incident at the angle =30. In Fig. 2(a), the minus-first reflected order is plotted versus groove width g. The plotted results are obtained by applying the rigorous coupled wave analysis (RCWA) [1,8] with N=35, where N is the truncation order of the Fourier series, and consequently 2N+1 is the total number of the retained space harmonics. The unwanted numerical artifacts are clearly observable in this figure. In Fig. 2(b), on the other hand, the same example is reexamined and artifact-free numerical results are obtained by applying the LPEM with N=35 and M=7. Here, M stands for the number of retained Legendre polynomial basis functions in terms of which each space harmonic is expanded [6]. Although the LPEM solves the same set of coupled differential equations as does the RCWA, and although the inverse rule in applying the LPEM has become invalid under the considered circumstances, the otherwise present numerical artifacts are obviously filtered out when the latter approach is followed. Interestingly, the obtained results in Fig. 2(b) Fig. 1. Geometry of a typical binary grating. virtually overlap with those obtained by using the extrapolation technique with N=60, shown by the dashed curve [3]. The observed agreement verifies that applying the LPEM with N=35 and M=7 has been as accurate as the extrapolation technique with N=60. To explain the observed phenomenon, one can argue that harsh and harmonically rich variations of electromagnetic fields arising from the interference of spurious modes as suggested in [4] are automatically filtered out when each space harmonic is projected in the linear space spanned by keeping M Legendre basis functions. In fact, if M is large enough to accurately approximate the physical variation of electromagnetic fields, and if it is small enough to filter out the very fast changes of Fourier space harmonics that are caused by the interference of highspatial-frequency spurious modes [4], then obtaining accurate and stable results is guaranteed. This argument is further expounded in Fig. 3, where the groove width is fixed at g=250 nm and the minus-first order reflected diffraction efficiency calculated by using the LPEM with M =6 (dotted curve), M=7 (dashed curve), and M=8 (solid curve) is plotted versus the space-harmonic truncation order N. The result obtained by using the extrapolation technique with 2N+1=301 space harmonics is also given in this figure as a reference. As is clearly shown, increasing M results in a more accurate value, but it needs a large enough number of space harmonics N. This is expected, as calculation of electromagnetic fields by using the LPEM with larger M is more liable to follow the harsh variations of space harmonics produced by the inevitable error of the truncated Fourier series. Fortunately, increasing the space-harmonic truncation order N is helpful and stabilizes the obtained results by further sharpening the numerical artifacts of the electromagnetic field profile in such a manner that it can no longer be approximated by keeping M basis functions. If M tends to infinity and the space harmonics are described accurately by Legendre polynomials, i.e., when LPEM is mathematically equivalent to the RCWA, the space-harmonic truncation order N must also be infinite to produce stable results [6]. On the other hand, if M is too small then the correct and physical variation of electromagnetic field cannot be accurately approximated by the retained Legendre polynomials, the truncation error Fig. 2. Minus-first reflected order versus the groove width g obtained by using (a) the RCWA with N=35 and (b) the LPEM with N=35 and M=7 (solid curve) and the extrapolation technique based on the RCWA with N=60 (dashed curve) for the grating shown in Fig. 1 illuminated by a TM polarized plane wave at =30 and with the vacuum wavelength =632.8 nm. Other parameters in Fig. 1 are d= G =500 nm, n c =1, n s = 10j.

3 A. Khavasi and K. Mehrany Vol. 26, No. 6/ June 2009/J. Opt. Soc. Am. A 1469 Fig. 3. Minus-first reflected order versus the truncation order N obtained by LPEM with M=8 (solid curve), M=7 (dashed curve), and M=6 (dotted curve). The groove width of the grating is fixed at g=250 nm. The reference value is obtained by using the extrapolation technique based on the RCWA with N=150 applied to a slightly lossier structure. of the Legendre polynomial expansion prevails, and the obtained results, though artifact-free, will be erroneous. The compromise is therefore that the number of retained Legendre basis functions should neither be unnecessarily large nor erroneously small. To further justify the statements we made in the previous paragraph, the transverse magnetic field profile of the highly conducting binary grating is more closely studied at g=360.4 nm where a large numerical artifact was conspicuous in Fig. 2(a). In Fig. 4(a), the RCWA with 2N+1 =71 space harmonics is employed and the magnitude of the transverse magnetic field is plotted. This figure clearly shows that the violation of the inverse rule validity leads to harsh and erroneous variations within the electromagnetic profile. A similar figure is also provided in [4], where the deteriorating interference effect of spurious modes is demonstrated (see Fig. 6 in [4]). In Fig. 4(b), on the other hand, the LPEM with N=35 and M=7 is employed and the magnitude of the transverse magnetic field is once again plotted. This time, the harsh behavior of the magnetic field is filtered out and the physical field profile is accurately approximated in the linear space spanned by keeping M=7 Legendre basis functions. The accuracy of this approximation is confirmed by comparing the obtained field profile in Fig. 4(b) to the field profile in Fig. 4(c) obtained by using the RCWA with N=35 applied to the slightly lossier structure with n s = j. It should be noted that N=35 in the analysis of this lossy structure has been large enough to guarantee an error level below 0.5%. It is thus demonstrated that M=7 in the analysis of a highly conducting binary grating with a thickness of about d =0.8 has been large enough to approximate the field profile accurately and small enough to eliminate the unwanted harsh variations arising from the truncated Fourier series. For highly conducting binary gratings with larger thickness, however, the number of retained Legendre polynomials M and therefore the truncation order of space harmonics N should both be increased. As an example, a very similar highly conducting binary grating, this time with the grating thickness of d=1 m and the groove width of g=252.4 nm, is considered. In Fig. 5, the minus-first order reflected diffraction efficiency calculated by using the LPEM with M=8 (dotted curve), M=9 (dashed curve), and M=10 (solid curve) is plotted versus the space-harmonic truncation order N. The result obtained by using the extrapolation technique with 2N+1 =301 space harmonic is also given as a reference. This figure clearly demonstrates that more Legendre basis functions are required to accurately approximate the physical electromagnetic field profile. Unfortunately, more Legendre basis functions call for more space harmonics to ensure the numerical stability. This is confirmed in Figs. 6 8, where the magnitude of the transverse magnetic field profile is plotted by using different approaches. In Figs. 6 and 7, the LPEM with N=29 and M=10 and the LPEM with N=40 and M=10 are applied to the same lossless structure with n s = 10j, respectively. In Fig. 8, on the other hand, the RCWA with N=35 is applied to the same structure made of a slightly lossier material with n s = j. Although keeping M=10 Legendre basis function is good enough to approximate the space harmonics accurately, the truncation order of space harmonics N=29 results in a transverse electromagnetic field profile with noisy fluctuations and thus should be increased to N=40, which removes nonphysical field variations. These figures thus show that increasing N is indeed helpful to eliminate numerical artifacts. Fig. 4. Spatial distribution of H y calculated by (a) RCWA with N=35 (b), LPEM with N=35 and M=7, and (c) by RCWA with N=35 applied to a slightly lossier structure with n s = j. The groove width of the grating is fixed at g=360.4 nm.

4 1470 J. Opt. Soc. Am. A/ Vol. 26, No. 6/ June 2009 A. Khavasi and K. Mehrany Fig. 5. Minus-first reflected order versus the truncation order N obtained by LPEM with M=10 (solid curve), M=9 (dashed curve), and M=8 (dotted curve). The groove width of the grating is g=252 nm and its thickness is d=1 m. The reference value is obtained by using an extrapolation technique based on RCWA with N=150 applied to a slightly lossier structure. Fig. 8. Spatial distribution of H y calculated by RCWA with N=35 applied to a slightly lossier structure with n s = j. The groove width of the grating is once again fixed at g=252.4 nm and the grating thickness is d=1 m. Fig. 6. Spatial distribution of H y calculated by LPEM with N=29 and M=10 applied to the lossless metallic grating with n s = 10j. The groove width of the grating is fixed at g =252.4 nm and its thickness is d=1 m. Regrettably, accurate analysis of thick gratings by applying the LPEM requires more Legendre polynomials [6]. Therefore, as is demonstrated in previous figures, retaining a large number of space harmonics is necessary to secure the stability of analyzing highly conducting thick binary gratings with the LPEM. Therefore, the whole strategy becomes time-consuming and memory-hungry. Although it might seem that this problem can be easily overcome by decomposing the thick structure into sufficiently thin slices and by using the appropriate R-matrix algorithm [7], the presence of numerical artifacts is intensified once a matrix propagation algorithm is applied. Therefore, the required truncation order of space harmonics N should be very large to ensure numerical stability. For example, if the diffraction efficiency of the latter example was to be stably extracted by applying the R-matrix algorithm and by decomposing the grating to two layers each with thickness of d=500 nm, then M=6 Legendre polynomial terms and 2N+1=101 space harmonics would have been necessary in the calculation. Even though M=10 would have been reduced to M=6, the number of required space harmonics would have undesirably increased from 81 to 101. Fig. 7. Spatial distribution of H y calculated by LPEM with N=40 and M=10 applied to the lossless metallic grating with n s = 10j. The groove width of the grating is fixed at g=252.4 nm and its thickness is d=1 m. 3. CONCLUSION We have shown that the numerical difficulties arising from the violation of the inverse rule validity in Fourierbased analysis of lossless metallic gratings can be eliminated by applying the LPEM. The unexpected stability of the LPEM as a Fourier- based method relying on the violated inverse rule is attributed to the fact that the truncated linear space spanned by the Legendre basis functions can automatically filter out unwanted numerical artifacts. The LPEM is shown to be quite fast in artifactfree analysis of thin highly conducting binary gratings but time-consuming and memory-hungry when applied to thick highly conducting binary gratings.

5 A. Khavasi and K. Mehrany Vol. 26, No. 6/June 2009/J. Opt. Soc. Am. A 1471 REFERENCES 1. L. Li, Use of Fourier series in the analysis of discontinuous periodic structures, J. Opt. Soc. Am. A 13, (1996). 2. E. Popov, B. Chernov, M. Nevière, and N. Bonod, Differential theory: Application to highly conducting gratings, J. Opt. Soc. Am. A 21, (2004). 3. K. Watanabe, Study of the differential theory of lamellar gratings made of highly conducting materials, J. Opt. Soc. Am. A 23, (2006). 4. N. M. Lyndin, O. Parriaux, and A. V. Tishchenko, Modal analysis and suppression of the Fourier modal method instabilities in highly conductive gratings, J. Opt. Soc. Am. A 24, (2007). 5. A. Khavasi, K. Mehrany, and A. H. Jazayeri, Study of the numerical artifacts in differential analysis of highly conducting gratings, Opt. Lett. 33, (2008). 6. A. Khavasi, K. Mehrany, and B. Rashidian, Threedimensional diffraction analysis of gratings based on Legendre expansion of electromagnetic fields, J. Opt. Soc. Am. B 24, (2007). 7. A. Khavasi, A. K. Jahromi, and K. Mehrany, Longitudinal Legendre polynomial expansion of electromagnetic fields for analysis of arbitrary-shaped surface relief gratings, J. Opt. Soc. Am. A 25, (2008). 8. M. G. Moharam, D. A. Pommet, E. B. Grann, and T. K. Gaylord, Stable implementation of the rigorous coupledwave analysis for surface-relief gratings: enhanced transmittance matrix approach, J. Opt. Soc. Am. A 12, (1995).

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