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CN102540462A - Maxwell-Garnett theory based design method for metal ceramic film photoelectric characteristics - Google Patents

Maxwell-Garnett theory based design method for metal ceramic film photoelectric characteristics Download PDF

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CN102540462A
CN102540462A CN201210037321XA CN201210037321A CN102540462A CN 102540462 A CN102540462 A CN 102540462A CN 201210037321X A CN201210037321X A CN 201210037321XA CN 201210037321 A CN201210037321 A CN 201210037321A CN 102540462 A CN102540462 A CN 102540462A
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metal
ceramic film
doping amount
film
dielectric constant
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杨平
张立强
陈敏
谢方伟
宋喜福
席涛
于新刚
杨修文
李霞龙
赵艳芳
刘健
王雪楠
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Jiangsu University
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Abstract

The invention discloses a Maxwell-Garnett theory based design method for metal ceramic film photoelectric characteristics. The method comprises the following steps of: selecting refractive indexes and dissipation coefficients of a dielectric material and a doped metal material, and calculating dielectric constants of the dielectric material and the doped metal material; calculating a dielectric constant, a refractive index and a dissipation coefficient of a metal ceramic film; calculating the transmissivity and the absorption coefficient of the metal ceramic film; and comparing a transmissivity or absorption coefficient design value required by the metal ceramic film with the calculated transmissivity or absorption coefficient, and if results are not consistent, modifying a value of a metal doping amount for repeated calculation until the results are consistent, wherein the metal doping amount when the results are consistent is the required final doping amount. The method has the characteristics of accuracy, scientificalness and high efficiency, and can comprehensively disclose a change rule of the metal ceramic film photoelectric characteristics with doped metals, doping amount, incident light wavelength and other parameters.

Description

Method for designing photoelectric characteristics of metal ceramic film based on Maxwell-Garnett theory
Technical Field
The invention relates to a metal ceramic film material (namely a metal oxide material), in particular to a design method for the photoelectric characteristic of a metal ceramic film.
Background
With the development of micro/nano/photoelectronic technology, thin film materials are widely used in the fields of lasers, solar cells, detectors, sensors, flat panel displays and the like. Thus, the properties of the thin-film material determine the properties of the thin-film component. A number of studies have shown that: a composite material formed by mixing two or more materials has optoelectronic characteristics that are not possessed by a single material. The cermet thin film is a composite thin film composed of metal and a ceramic material (dielectric material), and is widely used in optical devices, information storage, solar cells and the like because of its excellent optical characteristics, and the dielectric constant, refractive index, dissipation factor and the like of a doped metal have an important influence on the photoelectron characteristics of the dielectric material.
The Maxwell-Garnett theory was proposed by Maxwell and Garnett in 1904 and 1906, respectively, and was later called as the Maxwell-Garnett theory, abbreviated as MG theory. The theory considers that a very small amount of metal particles are dispersed in a medium matrix, the distance between the particles is large, no interaction exists between the particles, and the particles are scattered respectively; the particles are polarized induced by the transient field and the external field can be modified by the Lorentz (Lorentz) local field. The MG theory can be used for solving the characteristics of the metal ceramic dispersion microstructure such as dielectric constant and the like.
The main preparation methods of the current metal ceramic film include a vacuum evaporation method, a vacuum sputtering method, an ion plating method, a chemical vapor deposition method, a sol-gel method and the like. However, the design and manufacturing process of the cermet thin film is complicated because of the incompatibility of the cermet thin film material and the requirement of specific components, which require careful design and operation.
Disclosure of Invention
The invention aims to provide a method for designing the photoelectric characteristics of a metal ceramic film based on the Maxwell-Garnett theory, which can improve the accuracy and efficiency of the photoelectric characteristic design of the metal ceramic film, shorten the research and development period of a new product and reduce the cost.
The technical scheme adopted by the invention comprises the following steps in sequence:
(1) selection of refractive index
Figure 625057DEST_PATH_IMAGE001
Coefficient of dispersion
Figure 608056DEST_PATH_IMAGE002
And a selected refractive index
Figure 3266DEST_PATH_IMAGE003
Coefficient of dissipation
Figure 489742DEST_PATH_IMAGE004
The dielectric constant of the dielectric material is calculatedAnd dielectric constant of the doped metal material
Figure 782500DEST_PATH_IMAGE006
iIs an imaginary unit;
(2) according to the formula
Figure 981400DEST_PATH_IMAGE007
Calculating the dielectric constant of the cermet film
Figure 820918DEST_PATH_IMAGE008
Figure 79861DEST_PATH_IMAGE009
The initial doping amount is 0;
(3) according to the formula
Figure 771873DEST_PATH_IMAGE010
Calculating the refractive index of the cermet film
Figure 969953DEST_PATH_IMAGE012
And coefficient of dissipation
Figure 399798DEST_PATH_IMAGE013
Is dielectric constant
Figure 854230DEST_PATH_IMAGE008
The real part of (a) is,
Figure 497701DEST_PATH_IMAGE015
is dielectric constant
Figure 269086DEST_PATH_IMAGE008
An imaginary part of (d);
(4) according to the formula
Figure 998007DEST_PATH_IMAGE016
And
Figure 14505DEST_PATH_IMAGE017
calculating the transmittance of the cermet film
Figure 512482DEST_PATH_IMAGE018
And absorption coefficient
Figure 956233DEST_PATH_IMAGE019
Refractive index of air
Figure 172451DEST_PATH_IMAGE020
Figure 992639DEST_PATH_IMAGE021
Is the wavelength of the incident light;
(5) designing the transmittance or absorption coefficient of the desired cermet film transmittance to the transmittance
Figure 345123DEST_PATH_IMAGE022
Or absorption coefficient
Figure 723889DEST_PATH_IMAGE019
Comparing, if the results are not consistent, modifying the metal doping amount in the step (2)
Figure 161824DEST_PATH_IMAGE009
And (4) and then repeating the steps (3) and (4) until the results are consistent
Figure 520124DEST_PATH_IMAGE009
Is the desired final doping amount.
The invention has the beneficial effects that:
1. aiming at the film system design of the metal ceramic film, the invention calculates the photoelectric characteristic of the metal ceramic film based on Maxwell-Garnett (MG) theory, then selects proper doping metal and proportion to prepare according to the design requirement, or determines the optical constant of proper doping material according to the doping amount and medium material, and selects proper metal material to prepare. The design method has the characteristics of accurate and scientific calculation and high efficiency in the design of the photoelectric characteristics of the thin film, can comprehensively reveal the change rule of the photoelectric characteristics of the thin film material along with parameters such as doped metal, doping amount, incident light wavelength and the like, can improve the accuracy and efficiency of the design of the photoelectric characteristics of the metal ceramic thin film, can further reduce the research and development cost of the novel metal ceramic thin film, and provides a foundation for the design and development of the novel photoelectric material.
2. In order to overcome the complexity problem of design and manufacture, the invention can adopt a computer aided design technology, and uses computer simulation to calculate the optimal matching ratio and characteristic analysis, thereby improving the design efficiency of the film material and reducing the preparation cost.
Drawings
FIG. 1 is a flow chart of the calculation of the metal ceramic film design based on MG theory;
FIG. 2 MG theory-based cermet film dielectric constant with doping amountqThe variation curve of (d);
FIG. 3 is an optical constant of a cermet film based on MG theorynAccording to the doping amountqThe variation curve of (d);
FIG. 4 is an optical constant of a cermet film based on MG theorykAccording to the doping amountqThe variation curve of (d);
FIG. 5 metal ceramic based on MG theoryTransmittance T of ceramic film according to doping amountqThe variation curve of (d);
FIG. 6 MG theory-based cermet film transmittance T versus doped metal refractive indexnThe variation curve of (d);
FIG. 7 MG theory-based dissipation factor of cermet film transmittance T with doped metalkThe change curve of (2).
Detailed Description
According to Maxwell theory, the relationship between the dielectric constant and the optical constant of the nonmagnetic substance is as follows:
Figure 992694DEST_PATH_IMAGE023
Figure 840564DEST_PATH_IMAGE024
(1)
wherein,respectively a Real part (Real part) and an Imaginary part (Imaginary part) of the effective dielectric constant of the metal ceramic film;
Figure 192545DEST_PATH_IMAGE025
Figure 476896DEST_PATH_IMAGE026
the refractive index and the dissipation coefficient of the material are respectively, and the refractive index and the dissipation coefficient are collectively called as the optical constants of the material;irepresenting imaginary units.
According to MG dispersion microstructure theory, the dielectric constant of the metal ceramic composite film
Figure 349078DEST_PATH_IMAGE008
The dielectric constant that can be expressed by dielectric (ceramic) materials and doped metal materials is:
Figure 111498DEST_PATH_IMAGE027
(2)
in the formula,
Figure 293081DEST_PATH_IMAGE009
in order to dope the amount of the metal particles,
Figure 686016DEST_PATH_IMAGE028
is the dielectric constant of the dielectric material and,
Figure 585839DEST_PATH_IMAGE029
is the dielectric constant of the doped metal material;
the refractive index of the material can be found from the formula (1)
Figure 89633DEST_PATH_IMAGE012
And coefficient of dissipation
Figure 125722DEST_PATH_IMAGE013
The relationship between the real and imaginary parts of the dielectric constant of the cermet material is:
Figure 689558DEST_PATH_IMAGE030
(3)
most of the photoelectric characteristics (such as transmissivity, absorption coefficient, etc.) of a material have a relationship with the optical constants of the material, and when the material is injected from air, the transmissivity and the absorption coefficient of the material can be expressed as follows according to the law of refraction of light:
Figure 76677DEST_PATH_IMAGE016
(4)
(5)
wherein, the refractive index of air
Figure 773292DEST_PATH_IMAGE020
Is the wavelength of the incident light;
therefore, the dielectric constants of the ceramic dielectric material and the doped metal material are respectively obtained according to the formula (1) and the two optical constants (n, k) of the refractive index and the dissipation coefficient of the two materials, then the effective dielectric constant of the metal ceramic film is obtained according to the formula (2), and most of the photoelectric characteristics which are closely related to the dielectric constant of the metal ceramic film are obtained, such as: the transmissivity, the refractive index, the absorption coefficient and the like provide theoretical support for subsequent sample preparation.
During design, the photoelectric characteristics of the metal ceramic film can be simulated and calculated by using a computer simulation means of MATLAB programming, and then proper doped metal and proportion are selected according to design requirements, or the optical constant of a proper doped material is determined according to the doping amount and a dielectric material, and a proper metal material is selected and prepared. As shown in fig. 1, the design method of the present invention comprises the following specific steps:
the first step is as follows: selecting proper dielectric material and doping metal
The second step is that: initial parameters. In accordance with the design goals of the system,selecting optical constant refractive index of dielectric material and metal material
Figure 116866DEST_PATH_IMAGE031
And coefficient of dissipation
Figure 290359DEST_PATH_IMAGE032
Is an initial value of the design method. Wherein:
Figure 238723DEST_PATH_IMAGE033
1, the optical parameter of the ceramic dielectric material,and when =2, the optical parameters are optical parameters of the doped metal material.
Figure 240494DEST_PATH_IMAGE034
Is the initial doping amount of the doping metal (the initial value is 0). Namely: selecting refractive index according to the designed value of the transmittance of the metal ceramic film
Figure 686519DEST_PATH_IMAGE001
Coefficient of dispersionAnd a selected refractive index Coefficient of dissipation
Figure 913473DEST_PATH_IMAGE004
The dielectric constant of the dielectric material is calculated
Figure 163188DEST_PATH_IMAGE005
And dielectric constant of the doped metal material
Figure 86145DEST_PATH_IMAGE006
iIn units of imaginary numbers.
The third step: benefit toRespectively calculating the dielectric constant of the dielectric material according to the formula (1) by using the optical constant and the metal doping amount of the material selected in the second step
Figure 395904DEST_PATH_IMAGE035
Dielectric constant of doped metal material
Figure 404311DEST_PATH_IMAGE036
The fourth step: calculating the dielectric constant of the cermet film according to the third step using the formula (2)
Figure 457718DEST_PATH_IMAGE027
Calculating the real part of the dielectric constant by using the equation (1)And imaginary part
Figure 214376DEST_PATH_IMAGE038
The fifth step: using the real part and the imaginary part of the dielectric constant of the cermet film calculated in the fourth step, according to the formula (3),
Figure 506817DEST_PATH_IMAGE030
calculating refractive index of the cermet film
Figure 301598DEST_PATH_IMAGE012
And
Figure 995884DEST_PATH_IMAGE013
dissipation factor, two optical constants.
And a sixth step: calculating the optical characteristics of the metal ceramic film according to the optical constants of the metal ceramic film calculated in the fifth step, such as: transmittance, absorption coefficient, etc., i.e.: when light is irradiated into the metal ceramic film from air, the following can be known according to the law of refraction: cermet filmTransmittance of (4)
Figure 585128DEST_PATH_IMAGE016
Calculation of absorption coefficient
Figure 630445DEST_PATH_IMAGE039
Can be represented by formula (5)
Figure 963337DEST_PATH_IMAGE017
And (4) calculating.
The seventh step: depending on design goals, for example: in the visible light range, the transmittance of the film is required to be more than 80%, and the transmittance is judged and compared with the transmittance of the metal ceramic film obtained by the sixth step: if the transmittance T is<80%, modifying the metal doping amount
Figure 512130DEST_PATH_IMAGE009
Then, continuing to execute the third step of calculation until the design requirement is met, wherein the metal doping amount at the moment is the required final doping amount;
eighth step: the metal doping amount is output properly, and the optical constants (refractive index and dissipation coefficient) and optical characteristics (transmissivity, absorption coefficient, etc.) of the cermet thin film at that time are varied according to the doping amountqThe change curve provides a foundation for subsequent optimization design and film sample preparation.
One embodiment of the present invention is provided below.
Examples
ZnO is used as a novel direct wide-band gap II-VI semiconductor compound material, and is widely applied to the fields of lasers, solar cells, detectors, sensors, flat panel displays and the like due to the advantages of no toxicity, low cost, wide forbidden band, high temperature resistance and the like. In order to design a novel light control element or switch, it is desirable to design a light control element or switch with generally high transmittance in the visible range by Cu doping ((>80%) and is low in a certain wavelength rangeTransmittance. The design is described by taking ZnO (dielectric material) and Cu (doped metal material) as examples. At the wavelength of the incident light
Figure 600172DEST_PATH_IMAGE021
At 430nm, the doping amount
Figure 303423DEST_PATH_IMAGE034
=0.1 as an example:
first, the optical constants (refractive index and dissipation factor) and initial doping amount of ZnO material and Cu material in the visible light range are inputtedq 0 . Optical constant of ZnO
Figure 236744DEST_PATH_IMAGE001
=2.09,
Figure 843306DEST_PATH_IMAGE002
= 0.02; optical constant of Cu
Figure 102249DEST_PATH_IMAGE003
=1.097,=1.916;;
Second, dielectric constants of ZnO and Cu are respectively obtained according to the formula (1)
Figure 531274DEST_PATH_IMAGE040
=4.3677+0.0836i
Figure 992342DEST_PATH_IMAGE041
=-2.467+4.203i
Thirdly, the
Figure 834451DEST_PATH_IMAGE029
Calculation of the composition of the cermet film by the formula (2)Complex dielectric constant
Figure 375154DEST_PATH_IMAGE008
=4.2667+1.2305iReal part of dielectric constant
Figure 690728DEST_PATH_IMAGE014
) 4.2667 and imaginary component (
Figure 291474DEST_PATH_IMAGE015
) Is 1.2305.
Fourthly, the optical constants of the cermet films were calculated according to equation (3) as follows:
Figure 692499DEST_PATH_IMAGE042
=2.0873
Figure 36893DEST_PATH_IMAGE043
=0.2949
fifth, the photoelectric characteristics (transmittance, absorption coefficient, etc.) of the film are calculated from the optical constants of the cermet film obtained in the fourth step using equations (4) and (5) as follows:
Figure 472554DEST_PATH_IMAGE044
=0.8760
Figure 978621DEST_PATH_IMAGE017
Figure 194839DEST_PATH_IMAGE045
0.0349
according to the aboveCalculating the photoelectric characteristics of the metal ceramic film by the obtained optical constants (example: calculating the transmissivity and absorption coefficient of the film) and judging according to the design target, if not, modifying the doping amount and repeating the third step until the target requirement is met, and finally outputting the appropriate doping amount, the optical constants and the optical characteristics of the metal ceramic film along with the doping amountqProvides a basis for sample preparation.
FIG. 2 is a graph showing the dielectric constant of a cermet film calculated based on MG theory as a function of the amount of metal dopedqThe variation curve of (d); FIG. 3 and FIG. 4 show the different doping amounts of the cermet film with respect to the optical constantqThe change curve of (2). It can be seen that the dielectric constant and optical constant (refractive index, dissipation factor) of the cermet film depend on the doping amountqIs increased. FIG. 5 is a graph showing the variation of optical characteristics (transmittance) of a cermet film with metal doping amount, wherein the film has a low transmittance in the wavelength range of 430nm to 460nm, the transmittance in other visible light regions is above 80%, and the doping amount of Cu metalqLess than or equal to 0.5. Fig. 6 and 7 show the relationship between the transmittance of the cermet film and the optical constants (refractive index n and dissipation factor k) of the doped metal, as can be seen from fig. 6: in the visible light range, except when the refractive index of the doped metal is about 1.1, the transmittance of the cermet thin film using ZnO as a dielectric material is higher than 80%. And as can be seen in fig. 7: in the visible light range, except that the dissipation coefficient of the doped metal is 1.9-2.1, the transmissivity of the metal ceramic film taking ZnO as the dielectric material is higher than 80%. At the same time, it can be seen that: when the metal ceramic film with ZnO as a dielectric material is prepared and the transmissivity is required to be higher than 90%, a proper doped metal material can be selected within the range of Refractive index (Refractive index) of 1.1-1.3 and dissipation Coefficient (extraction Coefficient) of 1.4-1.8; conversely, if one wants to modulate a light control material or device in the visible region, it should modulate around a refractive index of 1.1 and an extinction coefficient of 2. The method provides a theoretical basis for the design of a novel light control component in a visible light range, and has certain value for shortening the research and development period and reducing the cost. Metals based on MG theoryThe design method of the ceramic film has certain theoretical value and guiding significance for novel film design and product research and development.

Claims (1)

1. A method for designing the photoelectric characteristics of a metal ceramic film based on the Maxwell-Garnett theory is characterized by sequentially comprising the following steps:
(1) selection of refractive indexCoefficient of dispersion
Figure 723637DEST_PATH_IMAGE002
And a selected refractive index
Figure 201210037321X100001DEST_PATH_IMAGE003
Coefficient of dissipation
Figure 519424DEST_PATH_IMAGE004
The dielectric constant of the dielectric material is calculated
Figure 201210037321X100001DEST_PATH_IMAGE005
And dielectric constant of the doped metal material
Figure 630599DEST_PATH_IMAGE006
iIs an imaginary unit;
(2) according to the formula
Figure 201210037321X100001DEST_PATH_IMAGE007
Calculating the dielectric constant of the cermet film
Figure 831161DEST_PATH_IMAGE008
Figure DEST_PATH_IMAGE009
The initial doping amount is 0;
(3) according to the formula
Figure DEST_PATH_IMAGE011
Calculating the refractive index of the cermet film
Figure 19883DEST_PATH_IMAGE012
And coefficient of dissipation
Figure DEST_PATH_IMAGE013
Figure 403590DEST_PATH_IMAGE014
Is dielectric constantThe real part of (a) is,
Figure 201210037321X100001DEST_PATH_IMAGE015
is dielectric constant
Figure 860165DEST_PATH_IMAGE008
An imaginary part of (d);
(4) according to the formulaAnd
Figure DEST_PATH_IMAGE017
calculating the transmittance of the cermet film
Figure 630992DEST_PATH_IMAGE018
And absorption coefficientRefractive index of air
Figure DEST_PATH_IMAGE021
Is the wavelength of the incident light;
(5) designing the transmittance or absorption coefficient of the desired cermet film transmittance to the transmittanceOr absorption coefficient
Figure 121383DEST_PATH_IMAGE019
Comparing, if the results are not consistent, modifying the metal doping amount in the step (2)And (4) and then repeating the steps (3) and (4) until the results are consistent
Figure 198590DEST_PATH_IMAGE009
Is the desired final doping amount.
CN201210037321XA 2012-02-20 2012-02-20 Maxwell-Garnett theory based design method for metal ceramic film photoelectric characteristics Pending CN102540462A (en)

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CN109374544A (en) * 2018-11-02 2019-02-22 天津津航技术物理研究所 The characterizing method of the aqueous depth of defect of optical medium film
CN110082313A (en) * 2019-04-22 2019-08-02 天津大学 A kind of micro-nano material refractive index measurement method based on prism-coupled instrument
CN113960512A (en) * 2021-11-03 2022-01-21 电子科技大学 Deduction calculation method for equivalent electromagnetic parameters of rubber plate type wave-absorbing material
WO2022193399A1 (en) * 2021-03-19 2022-09-22 苏州大学 Spectrally selective thermal radiator and design method therefor

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Cited By (7)

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Publication number Priority date Publication date Assignee Title
CN109374544A (en) * 2018-11-02 2019-02-22 天津津航技术物理研究所 The characterizing method of the aqueous depth of defect of optical medium film
CN109374544B (en) * 2018-11-02 2021-02-12 天津津航技术物理研究所 Characterization method of water-containing defect depth of optical medium film
CN110082313A (en) * 2019-04-22 2019-08-02 天津大学 A kind of micro-nano material refractive index measurement method based on prism-coupled instrument
CN110082313B (en) * 2019-04-22 2021-08-20 天津大学 Micro-nano material refractive index measurement method based on prism coupler
WO2022193399A1 (en) * 2021-03-19 2022-09-22 苏州大学 Spectrally selective thermal radiator and design method therefor
CN113960512A (en) * 2021-11-03 2022-01-21 电子科技大学 Deduction calculation method for equivalent electromagnetic parameters of rubber plate type wave-absorbing material
CN113960512B (en) * 2021-11-03 2023-03-14 电子科技大学 Deduction calculation method for equivalent electromagnetic parameters of rubber plate type wave-absorbing material

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Application publication date: 20120704