OPTICAL Optical properties of multilayer systems by computer modeling

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Workshop on "Physics for Renewable Energy" October 17-29, 2005 301/1679-15 "Optical Properties of Multilayer Systems by Computer Modeling" E. Centurioni CNR/IMM AREA Science Park - Bologna Italy

OPTICAL Optical properties of multilayer systems by computer modeling Emanuele Centurioni centurioni@bo.imm.cnr.it www.bo.imm.cnr.it/~centurio Workshop on "Physics for Renewable Energy" October 17-29, 2005 ICTP, Trieste, Italy

Summary main features of the software OPTICAL multilayer systems overview theory for R and T calculation theory for internal light absorption calculation a short training

Main features of the software OPTICAL Is a cross-platform software released under the GPL license (Open Source): written using Python, wxwindows, wxpython and BoaConstructor Can treat multilayers with any number of coherent and incoherent layer in any position and for any Incidence angle using a Generalized Scattering Matrix Method Can compute total light Reflectance, Transmittance, internal Absorption and internal Energy Flux EMA (Effective Medium Approximation) for mixed phase materials is integrated in the structure editor, many other function are present

Multilayer systems E. Centurioni, 24 October 2005, Trieste Layers are isotropic and homogeneous Reflected light R Incident light N1 N2 N3 N4 t1 t2 t3 t4 Transmitted light T Interfaces are plane and parallel T = 1 R A where A is the absorbed light

Coherent and incoherent behaviour of light Usually to simulate experimental spectral measurements of a multilayer system it is necessary to treat some layers as coherent (internal interference taken into account), and some other as incoherent (internal interference ignored). If the layer is very thick compared with the radiation wavelength and transparent, we should treat it as incoherent. If we don't we have multiple reflections leading to narrow oscillations in the calculated reflectance and transmittance spectra that are not present in the experimental data. Interference-destroying causes are the limited resolution of the instrument, the non perfectly parallel interfaces of a layer and the limited light source coherence length

Coherent and incoherent behaviour of light Computed Reflectance and Transmittance of 1 mm thick glass. Coherence (red) or incoherence (blue) has been used.

Basics of Transmittance and Reflectance calculation

Optical constants E. Centurioni, 24 October 2005, Trieste Each layer is defined by its complex index of refraction N N = n + ik where k is the extinction coefficient related to the absorption coefficient α α = 4 pi k / λ where λ is the wavelength. The dielectric constant ε is directly related to N ε = N 2

Reflection and refraction of plane waves Snell's law N i sin φ i = N J sin φ J Complex angles!

The Fresnel coefficients E. Centurioni, 24 October 2005, Trieste Ratio of reflected and transmitted electric field components

Wave propagation E. Centurioni, 24 October 2005, Trieste E(z 2 )=E(z 1 ) exp (i β (z 2 -z 1 )) β (x) = (2 pi x N cos φ) / λ (phase shift) Wave propagation in a homogeneous medium

Multiple boundary problem Using Snell's law, Fresnel coefficient and wave propagation equation the problem is analytically solvable (find solution for E). From the knowledge of the electric field R and T can be finally calculated. Quite complicated!

The scattering-matrix formalism (coherent) Light passing through this structure can be described with the scattering-matrix formalism, S is the 2x2 scattering-matrix

The scattering-matrix formalism (coherent) S is the 2x2 scattering matrix where I defines the wave propagation at the interfaces and L describes the wave propagation through the films I is associated to an interface L is associated to a layer

The scattering-matrix formalism (incoherent) Light passing through this structure can be described with the scattering-matrix formalism, S is the 2x2 scattering-matrix. U = E 2

The scattering-matrix formalism (incoherent) S is the 2x2 scattering matrix where I defines the wave propagation at the interfaces and L describes the wave propagation through the films I is associated to an interface L is associated to a layer

Mixed coherent and incoherent multilayer

Energy flux Φ ~ U s re (N cos φ) Φ ~ U p re (N* cos φ) E. Centurioni, 24 October 2005, Trieste Light energy flux for a single wave moving in a homogeneous medium The ambient medium on the light side must be transparent Transmission e reflection coefficients can be calculated from scattering matrix elements

Total Transmittance and Reflectance R = (R p + R s ) / 2 Transmittance T = (T p + T s ) / 2 For unpolarized light R s = r s R p = r p Reflectance

Light energy absorption inside the multilayer Reflected light R? Incident light Transmitted light T Light intensity approach A z1<z<z2 = Φ(z1) - Φ(z2) Energy flux approach

Energy flux inside the multilayer Incoherent layer: single wave moving equation can be used Coherent layer: Poynting vector

The Poynting vector E. Centurioni, 24 October 2005, Trieste The normalized Poynting vector gives the energy flux along the direction of propagation. Once the electric field profile is known the magnetic field B can be derived from Maxwell's equations, so it is possible to compute the energy flux using the complex Poynting vector Electric field profile inside a coherent layer in a mixed coherent / incoherent multilayer can be calculated using a full matrix formalism

A short training on OPTICAL

Example 1: simple interface Semi infinite Incident light φ Reflected light Top medium (tranparent) Usually air Semi infinite Transmitted light Bottom medium

Example 2: single layer E. Centurioni, 24 October 2005, Trieste Semi infinite Incident light Top medium (tranparent) Reflected light Semi infinite Transmitted light

Example 3: multilayer E. Centurioni, 24 October 2005, Trieste Semi infinite Incident light Reflected light Top medium (tranparent) Semi infinite Transmitted light

Other examples E. Centurioni, 24 October 2005, Trieste A simple mirror Thin film solar cell analysis Silicon solar cell, antireflecting coating Thickness determination, alpha calculation Interferential filter Pseudo dielectric functions

Conclusion E. Centurioni, 24 October 2005, Trieste Simulation of optical quantity like total transmittance (T), reflectance (R) and internal light absorption (A) are very useful in many fields like in optical coating design, solar cells optimization, thin film measurement systems, interferometric infrared absorber and emitter design, etc. OTICAL can do these task. OPTICAL is an open source project, multi platform, and available for free under the GPL license. References Optical can be downloaded here www.bo.imm.cnr.it/~centurio/optical.html E. Centurioni, Generalized matrix method for calculation of internal light energy flux in mixed coherent and incoherent multilayer, Applied Optics, in press.