Meshed doped silicon photonic crystals for manipulating near-field thermal radiation

Meshed doped silicon photonic crystals for manipulating near-field thermal radiation

Accepted Manuscript Meshed Doped Silicon Photonic Crystals for Manipulating Near-Field Thermal Radiation Mahmoud Elzouka , Sidy Ndao PII: DOI: Refere...

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Accepted Manuscript

Meshed Doped Silicon Photonic Crystals for Manipulating Near-Field Thermal Radiation Mahmoud Elzouka , Sidy Ndao PII: DOI: Reference:

S0022-4073(17)30357-6 10.1016/j.jqsrt.2017.09.002 JQSRT 5828

To appear in:

Journal of Quantitative Spectroscopy & Radiative Transfer

Received date: Revised date: Accepted date:

10 May 2017 5 September 2017 6 September 2017

Please cite this article as: Mahmoud Elzouka , Sidy Ndao , Meshed Doped Silicon Photonic Crystals for Manipulating Near-Field Thermal Radiation, Journal of Quantitative Spectroscopy & Radiative Transfer (2017), doi: 10.1016/j.jqsrt.2017.09.002

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Highlights 

Significant enhancement in near-field thermal radiation is realized using practical and achievable micrometric gap, rather than nanometric gaps considered in majority of literature.



Near-field thermal radiation between meshed photonic crystal structure is investigated, for



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the first time in literature. Enhancement in radiative heat transfer for meshed structures is 22 times higher than nonmeshed ones, which is promising for thermal rectification and thermal management applications.



First-principle method is used to simulate the random thermal vibrations of charges within



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the material (i.e., the main mechanism of electromagnetic thermal emission).

Resonant modes validated and visualized by solving Helmholtz equation using weak-form

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formulations.

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Meshed Doped Silicon Photonic Crystals for Manipulating NearField Thermal Radiation Sidy Ndao, corresponding author University of Nebraska-Lincoln Mechanical and Materials Engineering Lincoln, Nebraska, 68588-0526, USA [email protected]

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Mahmoud Elzouka University of Nebraska-Lincoln Mechanical and Materials Engineering Lincoln, Nebraska, 68588-0526, USA [email protected]

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Meshed Doped Silicon Photonic Crystals for Manipulating NearField Thermal Radiation

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Abstract The ability to control and manipulate heat flow is of great interest to thermal management and thermal logic and memory devices. Particularly, near-field thermal radiation presents a unique opportunity to enhance heat transfer while being able to tailor its characteristics (e.g., spectral

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selectivity). However, achieving nanometric gaps, necessary for near-field, has been and remains a formidable challenge. Here, we demonstrate significant enhancement of the near-field heat transfer through meshed photonic crystals with separation gaps above 0.5 μm. Using a firstprinciple method, we investigate the meshed photonic structures numerically via finite-difference

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time-domain technique (FDTD) along with the Langevin approach. Results for doped-silicon meshed structures show significant enhancement in heat transfer; 26 times over the non-meshed

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corrugated structures. This is especially important for thermal management and thermal

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rectification applications. The results also support the premise that thermal radiation at micro scale is a bulk (rather than a surface) phenomenon; the increase in heat transfer between two

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meshed-corrugated surfaces compared to the flat surface (8.2) wasn’t proportional to the increase in the surface area due to the corrugations (9). Results were further validated through good

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agreements between the resonant modes predicted from the dispersion relation (calculated using a finite-element method), and transmission factors (calculated from FDTD).

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1. Keywords Near-field thermal radiation; photonic crystals; finite-difference time-domain; first-principle; cluster computing; meshed structures..

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2. Introduction Manipulating heat transfer is of engineering interest for its potential applications in thermal storage, thermal management and thermal logic [1] and memory [2–4] devices. However,

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controlling heat transfer is a challenge due to the lack of perfect thermal insulators, unlike in the case of electricity. Vacuum is an efficient thermal insulator, however not perfect since radiative heat transfer can still flow through vacuum. Nevertheless, using near-field effects, thermal radiation enhancement and/or suppression through vacuum can result in desired tailoring of heat

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transfer.

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It has been demonstrated that near-field thermal radiation can enhance the radiative heat transfer dramatically, even beyond the classical theoretical limit of the blackbody radiation [5,6]. The

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transfer of thermal energy by near-field radiation occurs when a thermal emitter and receiver are brought very close to each other, at distances near or below the characteristic wavelength of

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thermal radiation. At this close proximity, in addition to propagating harmonic electromagnetic waves (as in the case of blackbody radiation), evanescent (i.e., non-propagating) waves which

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are confined to the thermal emitter’s surface (i.e., can only propagate along the surface) participate in the thermal energy transfer. The extra channels for heat flow created by these evanescent waves increase the rate of heat transfer exchange exponentially with decreasing separation gap (i.e., the smaller the gap, the stronger the evanescent fields are and the higher the thermal radiation exchange rate) [7,8]. These particularities of near-field thermal radiation make Page 4 of 25

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it ideal for thermal modulation applications, such as with thermal memory, thermal diode [9–13] and thermal switches [14,15]. Near-field thermal radiation has been of interest to scientists since the 1960s [16,17], and it has become increasingly an engineering research topic for the past two decades with advances in

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nano/microfabrication techniques. Research efforts to enhance near-field thermal radiation range from the use of nano/microstructures [18–23], thin layers of polar dielectrics [24,25], patterned layers of graphene [26,27], extremely-thin photonic crystals [28] and metal-dielectric structures

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that have hyperbolic dispersion [29–31]. Despite the numerous approaches, very few are

practical from the engineering standpoint; thin films of polar dielectrics [32] would be an example. Most significant engineering barriers include the fabrication of nanometric separation gaps and the implementation of exotic materials such as graphene.

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In this paper, we are introducing a practical method for enhancing near-field thermal radiation,

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without necessarily using extremely small nanometer gaps. We propose using meshed photonic crystals with variable separation gaps as shown in Figure 1. The meshing increases the area

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available for heat transfer by thermal radiation and introduce new resonant electromagnetic modes. Both effects are expected to enhance the rate of radiative heat transfer. The meshed

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photonic crystals have a minimum separation gap of 0.5 μm, achievable with standard microfabrication techniques (i.e., projection lithography and deep reactive ion etching). We used

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gratings since they are one of the simplest structures and have commonly been used in optics applications. The photonic crystals are made out of doped-silicon which is fully compatible with most standard microfabrication techniques, well characterized, and most importantly, its optical properties can be controlled by varying its doping level [33]; it can be engineered to act as an opaque metal or transparent dielectric. We investigated the meshed photonic crystal numerically Page 5 of 25

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using a first principle finite-difference time-domain technique (FDTD). The technique solves Maxwell’s equations with added fluctuating current source (to simulate thermal radiation source). We investigate the effect of tooth depth and meshing on the heat transfer and discuss the resonant modes leading to the observed enhancement in heat transfer. In parallel, we calculated

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the dispersion relation using finite-element method to verify the resonance frequencies in heat transfer from the FDTD results.

3. Methods

defined by its period , tooth height , and base thickness

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The geometry of the meshed photonic crystal investigated in this study is shown in Figure 1. It is , spacing between meshed teeth

, separation distance

. We model the near-field thermal radiation using a first-principle

technique that simulate the source, scattering and absorption of thermal electromagnetic waves.

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We use finite-difference time-domain (FDTD) method to solve Maxwell’s equations with

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random fluctuating current density source to represent the origin of thermal radiation. We adopted the same method introduced by Luo et. al. [34] to simulate the fluctuating current based

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on the Langevin approach. With this method, a simple variation is made to the FDTD algorithm [35] by introducing a randomly fluctuating component (in both magnitude and direction) to the

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polarization equation. The polarization equation defines the material’s polarization response due

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to local electric field, and it is used to update the value of the electric field in time stepping through the FDTD algorithm [34]

(1)

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is the vacuum permittivity. ,

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where

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Figure 1: Meshed photonic crystal layout (a) and computational domain (b-c) and

are the parameters of the Lorentz damped-

harmonic oscillator model that describes the polarization response to electric field.

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frictional coefficient or scattering rate, resonant frequency.

is the plasma frequency, and

is the

is the polarization

is a random variable added to the polarization equation to introduce

thermal fluctuations. In this work, we use doped-silicon which optical properties in the infrared regime (λ > 2 μm) can be modeled using the Drude model [33]. The photonic crystal structures

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are modeled using heavily doped-silicon (p-type model parameters:

) with the following Drude

,

, and

.

To simulate the source of thermal radiation, the random fluctuations in the current density need





Where

(

)

is the current density in direction

(x, y, or z),

(2)

is the mean energy of Planck’s

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oscillator;

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to follow the fluctuation-dissipation theorem:

are Dirac delta functions, indicating that currents are uncorrelated in

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and

(3)

both spatial space and frequency domain.

is the Kronecker delta which equal 1 for

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and zero otherwise, for an isotropic medium.

,

is the imaginary part of the relative permittivity

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of the material incorporating the fluctuating current, and

is the permittivity of free space.

To achieve fluctuations in current density that satisfies equation (2),

needs to have a



(4)

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frequency profile of the form [34]:

where

is a constant comprising material’s parameters and volume of discretization elements

used in FDTD. The correlation in equation (4) is colored noise and it is possible to incorporate it in the FDTD algorithm. However, there are two inconveniences: the simulation will be only valid for a fixed temperature (used to calculate

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), and the generating colored noise needs

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more computation power and memory than the simple Gaussian white-noise [36]. Therefore here, we exploit the linearity of Maxwell’s equations and assume fluctuations in

as a white-

noise with flat spectral density (i.e., constant amplitude in frequency domain). The resulted solutions are scaled with respect to

to account for the temperature-dependent current

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fluctuations.

Since the simulated structures have a discrete periodicity in x-direction and continuous

periodicity in z-direction, we simulate only one unit cell of the structure (as shown in Figure 1),

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and infer the solution of the infinitely periodic structure using Bloch’s theorem [37]. Bloch’s theorem dictates Bloch periodic boundary condition at the boundaries normal to directions of periodicity (i.e., x and z directions), which describes the relationship between the fields (e.g.,

is the period or the length of the unit cell in x-direction, and

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where

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electric field ) at the two adjacent sides as;

(5) is the Bloch

wavevector that dictates the phase shift between the two sides of the unit cell. The solution of the

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electromagnetic problem of the infinitely periodic structure in x direction is the superposition of

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all the solutions of a unit cell with Bloch periodic boundary condition, with all the values of that satisfy unique solutions (note that

of

gives the same solution). The range

which satisfies unique solutions is termed as Brillouin zone [37]. We can choose any range

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of

and

on condition that we have a span of

, so we have chosen

range to be

. Since our unit cell is symmetric about x axis, we expect that solutions with

identical to solutions with

. Therefore, we can solve our problem only for the range

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to be

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. Here, we assumed a constant value of values of

, and we didn’t solve for different

since they have a minimal effect on the spectral shape of the flux [18,28].

The boundaries of the unit cell normal to the y-direction are open boundaries with no reflection

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to electromagnetic waves. To simulate an open boundary, we use an artificial perfectly matched layer (PML) [38] with thickness

and padding distance

, see Figure 1.

To calculate the net thermal radiative energy transfer from the emitter to the receiver, or the energy absorbed by the receiver, we calculate the difference between electromagnetic energy

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crossing the two boundaries denoted by the dashed lines in Figure 1 b-d. The energy flux can be calculated by integrating the Poynting vector over the surface. The energy flux absorbed by the receiver (the bottom structure), due to randomly-fluctuating current distributed over the emitter (the upper structure) at a particular Bloch wavevector is denoted by

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fluctuations in the simulation are generated from a white-noise

. Since the current

term, the actual heat flux

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corresponding to a certain Bloch wavevector should be represented by total heat flux is obtained by integrating over the

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spanning over one Brillouin zone (i.e.,

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);

, and the

(6)

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In this study, we run the simulation with

step of

equal to the surface emissivity (or absorptivity) at far-field at ), and we named

. We scaled the

to be

(i.e., for a blackbody,

the spectral transmission factor. Since we incorporate

random values in our simulation, the results include noise which can be cancelled out by repeating the simulation over a number of times (~ 30) and averaging the results from all the Page 10 of 25

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runs. The number of averaged simulation runs depends on the running time for each individual run. In this work, we utilized a free open-source implementation of the FDTD algorithm called Meep (an acronym for MIT Electromagnetic Equation Propagation) [35]. We used finite-element method to investigate the dispersion relation of resonant modes created

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between the toothed structures and to compare them to resonant frequencies and wavevectors from FDTD simulations. The method is based on converting the Helmholtz eigenvalue equation to a weak form, which can be solved using any finite-element technique. The details are

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explained by Parisi et. al. [39]. This method incorporates the material dispersion and losses,

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which resulted in accurate prediction of resonant frequencies.

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4. Results and discussion 4.1. Effect of tooth height We investigate the effect of tooth height on the near-field thermal radiation. For transverse

and two photonic crystals designs with tooth heights of

and

for flat slabs

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magnetic (TM) waves, Figure 2 shows TM waves transmission factors

and tooth spacing

. The transmission factor is calculated between two structures with spacing

.

For the sake of validation, we have plotted the transmission factor calculated analytically using

wave vector

can be estimated by ∑

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Green’s function method [40] for the flat slab case; transmission factor corresponding to a Bloch , where

is an integer. Resonance

peaks appear on the corrugated structures for all values of the Bloch wavevector as seen on

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Figure 2, unlike with the flat slab. The corrugated structures add new resonant modes which act as additional channels to tunnel photons from the emitter to the receiver. The -

-height

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toothed structure results in higher number of resonant modes in comparison to the -

-height

one at lower frequencies. This can be explained by taking a closer look at the magnetic field of

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resonant modes that is shown in Figure 2-b. The first three magnetic field profiles (A1, A2 and and -

-height

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A3) and the second three profiles (B1, B2 and B3) are corresponding to

toothed structures, respectively. The magnetic field profiles show waveguide-like modes of first,

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second and third orders, which can be distinguished by counting the number of nodes inside the cavity. Note that the fields don’t look uniform due to the losses incorporated in the prediction of the field profiles, an advantage of using the weak form formulation in solving the Helmholtz eigenvalue equation [39]. The waveguide-like modes are known to have a lower cut-off frequency (i.e., the frequency of the lowest order mode) for a larger cavity height. Therefore, the

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Figure 2: Effect of tooth height on the transmission factor for TM waves

-height toothed structure shows resonant modes at lower frequencies than the -

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-

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a) spectral transmission factor for different tooth height at different Bloch wavevectors. Transmission factors for the flat slab are calculated analytically and represented by dotted lines. b) Plot of the magnetic field component in z direction for resonant modes at locations marked in (a) and marked in the dispersion relation in Figure 4-b. Mean energy of Planck’s oscillator is scaled to fit the plot. -deep

ones. It is also important to note from the plots the high transmission factors at infrared frequencies for the toothed structures at high values of Bloch wavevectors ( above) in comparison to the nearly zero transmission factor for the flat surface.

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The additional resonant modes introduced by the corrugated structures and their prevalence at large Bloch wavevectors result in enhancement of the radiative heat transfer over the flat slab as shown in the integrated transmission factor

at the bottom of Figure 2-a and explicitly

supported by the total heat transfer plots in Figure 5-b. However, the enhancement in

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transmission factors from these resonant modes applies only to TM waves. For transverse electric (TE) waves, there are no resonant modes since the doped-silicon has no magnetic

response, and the photon tunneling due to total internal reflection is dominant. The larger the surface area through which the frustrated total internal reflection occurs, the higher the expected

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heat transfer. Therefore, for TE waves, the flat slab shows higher rate of heat transfer than the corrugated structures separated by

gap, as shown in Figure 5-a. This is because the flat

slabs have higher heat transfer surface area at small gaps than the corrugated surfaces. The case

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4.2. Effect of tooth meshing

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is different when meshing occurs, as will be discussed in the next section.

It is intuitive from the experience with heat transfer at macro scale to expect the rate of heat

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transfer to be proportional to the surface area. This picture is valid as long as the heat transfer is a surface phenomenon (i.e., thermal radiation is emitted and absorbed by a small layer close to the

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surface). The case is different at microscale, where we need to consider the thermal radiation

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absorbed by and emitted from points across the entire material (i.e., bulk), such as in the case of the present meshed photonic structures. Figure 3-a shows the transmission factors for two corrugated structures with tooth height of 8 μm as a function of separation gap, dc, as shown in the schematic in Figure 3-b. Negative values of dc correspond to cases where meshing occurs. Figure 3-a shows a decrease in the number of resonant modes at low

values with decreasing

separation gap. This is due to the reduction in the volume available for the resonant waveguidePage 14 of 25

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Figure 3: Effect of structures meshing on transmission factor.

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(a) spectral transmission factor for different separation gaps at different Bloch wavevectors for TM waves. (b) schematic shows the toothed structures at four different separation gaps of -7.5, -2.5, 0.5 and 10 . (c) magnetic field profiles for the first three modes of fully meshed structures with . The eigenmodes locations are indicated in (a) and in Figure 4-c. like modes. However, the smaller the separation gap, the higher the transmission factor of the

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resonant modes at higher

values, and the stronger the resonant modes are; note the absence of

resonant modes for structures with a separation distance of

at

separation gap results in enhancement of the integrated transmission factor the bottom plot of Figure 3-a.

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. Decreasing the , as shown at

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Figure 4: Dispersion relation for resonant modes between two toothed structures

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All structures have the same period and tooth separation . a) dispersion relation for , and . b) and c) are dispersion relations for , and and , respectively. The grayscale intensity of each point represents the ratio in field intensity across one unit cell. The filled contour plot in (c) represents the spectral transmission factor, and it shows the agreement between the resonance points and the peaks in the transmission factor. Here, the most important effect of meshing is the enhancement in transmission factors from non-

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resonant modes (i.e., total internal reflection) in comparison to the non-meshed cases; this

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enhancement is clearly observable at frequencies away from the resonance frequencies. This contribution from non-resonant modes increases with decreasing separation gap. As can be seen

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on the integrated transmission factors plot, the fully meshed photonic crystal ( has almost no resonance, while the resonance is more noticed for the case of

) .

Dispersion relation for the fully-meshed structures (Figure 4-c) shows a continuum of states without any gap for all frequencies of interest. The dispersion relation is similar to case of wave propagating in isotropic medium, or a layered medium with low contrast in refractive index. This Page 16 of 25

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Figure 5: Total heat transfer scaled to heat transfer of flat slabs separated by 7-μm gap, for a) TE, b) TM and c)TE+TM contributions. case is known to have no band gaps and can support waves with all frequencies. The case is different from the wave guide-like dispersion shown in Figure 4-b for two separated structure,

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which has a couple of pseudo band gaps.

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4.3. Effect of separation distance on total heat transfer We calculate the total heat transfer



between the toothed structures for different

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designs and multiple separation distances; results are shown in Figure 5 for TE, TM and TE+TM waves. In the figure, the heat transfer

aparts. Since there are no TE surface resonant modes for non-magnetic material

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surfaces

is scaled to the total heat transfer between two flat

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structures [41], such being the case here, the radiative heat transfer for TE modes is mediated by propagating modes or evanescent modes from frustrated total internal reflection. Therefore, the radiative heat transfer is dependent on surface area. This can be seen on Figure 5-a at the separation gap of

, where the flat surfaces outperform corrugated structures due to the

higher surface area available for frustrated total internal reflection to occur. Note also the similar heat transfer values for the two structures, tooth height of Page 17 of 25

and

, but same

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the separation gap of

. This similarity is the result of the two surfaces having the same

overlapped surface area. The heat transfer rates for structures with the ones with

are higher than

, further supporting that heat transfer from TE modes depend heavily

surfaces [30].

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on the surface area available for total internal reflection and the separation between those

With TM modes (Figure 5-b) however; the structured surfaces outperform the flat surfaces at all separation gaps, by over an order of magnitude for the case of

and

of

and

but different

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Comparing the heat transfer for the two structures having the same

.

, we find that the values of heat transfer are almost identical when the

structures are meshed, although the separation gap between the two surfaces is different. This shows that the effect of resonant modes on the heat transfer is much stronger than the effects of

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frustrated total internal reflection.

and

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It is worth noting that the heat transfer from TE (TM) modes at the fully meshed case for is higher than the case of heat transfer between two flat surfaces by a factor of

. The enhancement in heat transfer is

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with separation gap

expected to be enhanced by a factor equal to the increase in the surface area resulted from

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corrugation (

), based on the classical view of thermal radiation (i.e., radiative

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heat flux is proportional to the area of surfaces exchanging the heat). However, the enhancement in heat transfer was

for TE (TM) modes, which is less than the augmented surface area

ratio of 9. This has two reasons; the heat flux per unit surface area between parallel infinite surfaces should be higher than the heat flux between surfaces with a finite length of the structure’s teeth). The second reason is that tooth width,

, is thinner than the

penetration depth of radiation. Overall, fully meshed structures achieved enhancement in Page 18 of 25

(i.e.,

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radiative heat transfer 26 times higher than the non-meshed structures separated This enhancement could result in thermal rectifications (

apart.

) as high as 2500% making

meshed photonic crystals ideal for thermal management applications such as thermal memory

5. Conclusions

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and thermal diodes.

We have investigated meshed photonic crystals to enhance near-field radiative heat transfer between two structures at a minimum separation gap of

. The goal is to achieve

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enhancement in radiative heat transfer at practical separation gaps other than the nanometric gaps suggested in the literature. We have solved for the radiative heat transfer using a first-principle method; FDTD with the Langevin approach to simulate the thermal fluctuating currents. The

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enhancement in the heat transfer from non-meshed corrugated structures relative to a flat slab has been mainly attributed to TM resonant modes. In the case of meshed photonic crystals, further

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enhancement in heat transfer resulted from the contribution of non-resonant modes (i.e., frustrated total internal reflection), which increases proportionally with surface area. We

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calculated the dispersion relation for the meshed and non-meshed cases using finite-element

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method; calculated resonant frequencies were in agreement with the results from the FDTD simulations. The dispersion relations for the non-meshed structures were similar to wave-guide

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resonant modes. In the case of meshed structures, the dispersion relation was similar to that of a homogenous media or layered media with low contrast in dielectric constant, which shows a continuum of states at all frequencies of interest to thermal radiation. Using meshed structures with a minimum separation gap of

, we were able to demonstrate enhancement in

radiative heat transfer as high as 26 times when compared to non-meshed structures. This

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enhancement could result in thermal rectifications as high R=2500% (R = (Qmeshed – Qnon-meshed)/ Qnon-meshed ×100%); by incorporating the corrugated structures into NanoThermoMechanical rectifier [13], for instance. The high contrast in heat transfer between meshed and non-meshed cases makes meshed photonic crystals ideal for thermal management applications such as

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thermal memory and thermal diodes.

Acknowledgment

This work was supported by the National Science Foundation (NSF) through the Nebraska

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Materials Research Science and Engineering Center (MRSEC) (grant No. DMR-1420645). This work was completed utilizing the Holland Computing Center of the University of Nebraska, which receives support from the Nebraska Research Initiative. We would like to also thank Prof.

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Christos Argyropoulos for the insightful conversations on electromagnetics modeling.

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