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Melt Pond Scheme Parameter Estimation Using an Adjoint Model

本站小编 Free考研考试/2022-01-02

Yang LU,
Xiaochun WANG,,
Jihai DONG

Corresponding author: Xiaochun WANG,xcwang@nuist.edu.cn;
School of Marine Sciences, Nanjing University of Information Science and Technology, Nanjing 210044, China
Manuscript received: 2020-09-04
Manuscript revised: 2021-03-02
Manuscript accepted: 2021-03-31
Abstract:Melt ponds significantly affect Arctic sea ice thermodynamic processes. The melt pond parameterization scheme in the Los Alamos sea ice model (CICE6.0) can predict the volume, area fraction (the ratio between melt pond area to sea ice area in a model grid), and depth of melt ponds. However, this scheme has some uncertain parameters that affect melt pond simulations. These parameters could be determined through a conventional parameter estimation method, which requires a large number of sensitivity simulations. The adjoint model can calculate the parameter sensitivity efficiently. In the present research, an adjoint model was developed for the CESM (Community Earth System Model) melt pond scheme. A melt pond parameter estimation algorithm was then developed based on the CICE6.0 sea ice model, melt pond adjoint model, and L-BFGS (Limited-memory Broyden-Fletcher-Goldfard-Shanno) minimization algorithm. The parameter estimation algorithm was verified under idealized conditions. By using MODIS (Moderate Resolution Imaging Spectroradiometer) melt pond fraction observation as a constraint and the developed parameter estimation algorithm, the melt pond aspect ratio parameter in CESM scheme, which is defined as the ratio between pond depth and pond area fraction, was estimated every eight days during summertime for two different regions in the Arctic. One region was covered by multi-year ice (MYI) and the other by first-year ice (FYI). The estimated parameter was then used in simulations and the results show that: (1) the estimated parameter varies over time and is quite different for MYI and FYI; (2) the estimated parameter improved the simulation of the melt pond fraction.
Keywords: CICE6.0,
Sea ice model,
Melt pond,
Parameterization scheme,
Adjoint Model,
Parameter estimation,
Arctic
摘要:融池显著影响着北极海冰的热力学过程。洛斯阿拉莫斯海冰模式(CICE6.0)中的融池参数化方案可以预测融池的体积、覆盖率(模式网格中融池面积与海冰面积的比值)和深度。然而,该方案存在一些影响融池模拟的不确定参数。使用常规的参数估计方法来确定这些参数需要大量的敏感性试验,而伴随模式能有效地计算参数敏感性。在本研究中,作者建立了一个社区地球系统模式(CESM)融池参数化方案的伴随模式。基于CICE6.0海冰模式、融池伴随模式和有限内存Broyden-Fletcher-Goldfard-Shanno极小化算法(L-BFGS),提出了融池参数估计算法,并在理想条件下对参数估计算法进行了验证。在北极的一个多年冰区域(MYI)和一个一年冰(FYI)区域,作者利用中分辨率成像光谱仪(MODIS)的融池覆盖率观测作为约束,结合融池参数估计算法,在夏季每8天对CESM方案中的融池纵横比参数(定义为融池深度与融池覆盖率之比)进行估计,然后将估计的参数值用于随后的模拟。模拟结果表明:(1)估计参数值随时间而变化,且MYI和FYI区域的估计参数值差异较大;(2)估计参数值的使用改进了融池覆盖率的模拟效果。
关键词:CICE6.0,
海冰模式,
融池,
参数化方案,
伴随模式,
参数估计,
北极





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During Arctic summer, sea ice and snow begin to melt to produce meltwater. The meltwater flows on the ice surface under the force of gravity and converges at the lower sites to form melt ponds of various sizes. Due to its high albedo, sea ice reflects most of the incident shortwave radiation. The melting of sea ice reduces its albedo and leads to more heat absorption by the polar regions, which further enhances sea ice melting. This is called the sea ice-albedo positive feedback (Curry et al., 1995). Since the albedo of melt ponds is much lower than the bare ice, the formation of melt ponds enhances the sea ice-albedo feedback and thus leads to further melting. Therefore, melt ponds play an important role in the polar climate system, which has become an intensive research topic in recent years. As the Arctic sea ice melting intensifies (Zhang et al., 2009), MYI (multi-year ice, defined as sea ice which has survived at least two summers without melting (according to the sea ice nomenclature by World Meteorological Organization (WMO, 2014)) has suffered severe losses, and the proportion of FYI (first-year ice) has significantly increased (Kwok, 2007; Maslanik et al., 2007). Due to its flat ice surface, FYI is favorable for melt ponds with large areal coverage. It is expected that the melt ponds will exert a more significant impact on the Arctic climate in the future. For the above reasons, studies on melt ponds and its parameterization in sea ice models are of great significance.
Due to the natural limitations of the Arctic environment, in-situ observations of melt ponds have always been lacking. The melt pond area fraction (MPF) and albedo are the key variables that require observation. During the Surface Heat Budget of the Arctic Ocean Project (SHEBA), the albedo of melt ponds was measured for seven months from April through October and was found to change rapidly in the range of 0.1?0.65 over this time span (Perovich et al., 2002). This variation is closely related to the temporal evolution of melt ponds. Based on observations, Eicken et al. (2004) pointed out that there are generally four stages in melt pond evolution: 1) stage of melt pond formation, 2) stage of meltwater drainage, 3) stage of melt pond stable expansion, 4) stage of melt pond refreezing. These stages are characterized by different mechanisms. Remote sensing provides a new method to collect data for melt pond observation. In 2012, R?sel et al. (2012) used the Moderate Resolution Imaging Spectroradiometer (MODIS) reflectance data to retrieve MPF and provided a data source from May to September 2000?11. Ding et al. (2020) developed a new MPF dataset from 2000 to 2019 based on a deep neural network using MODIS surface reflectance. This new dataset showed great potential for future applications in model parameter estimation and data assimilation for its higher accuracy compared with previously published data. In recent years, microwave remote sensing has been used to observe melt ponds (Scharien et al., 2014; Han et al., 2016; Tanaka et al., 2016), these works demonstrated the potential to produce high-resolution melt pond observations but there are no available products yet. Both field and satellite observations show that the melt pond processes have an obvious spatio-temporal variability. This characteristic needs to be considered in the melt pond parameterization schemes in sea ice models.
The parameterization of melt ponds in sea ice models is a very important research topic. Due to the variations of melt ponds in time and space, directly specifying a fixed albedo for certain types of ice surfaces may cause large simulation errors (Perovich et al., 2002). To calculate a more realistic albedo in sea ice models, it is necessary to develop a melt pond scheme and incorporate it into the sea ice models. Melt pond observation is the foundation for the development of melt pond schemes. There are several melt pond schemes of different complexity. Early-stage melt pond schemes consist of one-dimensional models or two-dimensional models (Taylor and Feltham, 2004; Lüthje et al., 2006; Scott and Feltham, 2010). However, these early schemes fail to align with the sea ice models in use and cannot be incorporated into them.
Holland et al. (2012) proposed a simple melt pond scheme. This scheme can calculate melt pond volume, melt pond fraction, and depth based on a given pond aspect ratio parameter, which is defined as the ratio between average melt pond depth and melt pond area fraction of a model grid cell. The scheme is adopted in the Los Alamos sea ice model (CICE) as the CESM (Community Earth System Model) parameterization scheme. A more complex melt pond scheme was developed directly based on an ice thickness distribution function (ITD) in sea ice models (Flocco and Feltham, 2007; Flocco et al., 2010). The ice surface topography is determined according to ice thickness. The influence of the ice surface topography on the horizontal transport of meltwater is also considered along with the percolation drainage through the permeable ice. This scheme was incorporated into the CICE model as the topography scheme. Hunke et al. (2013) developed the level ice scheme. Based on level ice tracers in CICE, melt ponds are only allowed to exist on level ice. The change of melt pond volume is separated into area and depth, similar to the CESM scheme.
However, these melt pond parameterization schemes are based on several assumptions and include parameters with large uncertainty. Using inappropriate parameters can potentially downgrade the accuracy and reliability of the sea ice models (Polashenski et al., 2012). Generally, sensitivity analysis is often used to study and reduce the uncertainty of these parameters, but in the case of a large number of interdependent parameters, the computational cost of this method is huge and can be prohibitive. The adjoint model provides another possibility for parameter estimation (Kim et al., 2006; Fenty et al., 2017). The adjoint model is the adjoint of the tangent linear model of the original forward model. The derivative of the model output with respect to all model input, including boundary conditions, initial conditions, and model parameters could be obtained through an integration of the adjoint model. Thus, the parameters are estimated quantitatively and efficiently. Adjoint models have been widely used in model parameter estimation and initial condition estimation. For instance, Liu and Zhang (2018) used the MITgcm (Massachusetts Institute of Technology general circulation model) sea ice-ocean coupled model and its adjoint model to study the optimization of the initial condition of sea ice fraction in the sea ice model. The estimated sea ice concentration is closer to the observation than the simulation using the unadjusted initial condition. This result indicates that the adjoint model can be used in the adjustment of the initial field of sea ice models. Fenty et al. (2017) used the MITgcm model and its adjoint model to estimate the coupled sea ice-ocean state for 2004, by assimilating ocean hydrological data and sea ice concentration data. Both the ocean and ice state estimations are more accurate compared to the estimations without assimilation. Kim et al. (2006) used the CICE model and its adjoint model to make a sensitivity analysis of 21 thermodynamic and dynamic parameters in the model. The sensitivities are later used to carry out an estimation of the parameters. This work explores the application of the adjoint model in sea ice model parameter estimation and optimization. The aforementioned research indicates that the adjoint model is useful in parameter estimation of sea ice models, yet melt pond parameters are not considered in these studies. Due to the importance of melt pond to sea ice modeling and existing parameter uncertainty in melt pond schemes, it is interesting to use the adjoint model to estimate and optimize the key melt pond parameters. Implementation of this method should reduce the simulation errors of melt ponds in sea ice models.
In this study, an adjoint model for a melt pond scheme in the CICE6.0 is developed, and the parameters in the melt pond scheme are estimated. The CESM scheme is chosen because of its simplicity in terms of the physical process which is well-suited for adjoint model development. In section 2, the CICE6.0 sea ice model, CESM melt pond parameterization scheme, the adjoint model is developed, and the L-BFGS (Limited-memory Broyden-Fletcher-Goldfard-Shanno) minimization algorithm (Liu and Nocedal, 1989), and datasets are described. Section 3 introduces the verification of the melt pond parameter estimation algorithm and analyzes the parameter estimation results of Arctic sea ice. Section 4 presents the main conclusions and discusses the limitations of our research.

2. Data and Methodology
2
2.1. Observation of melt pond fraction, sea ice concentration, and sea ice thickness
--> The MODIS MPF data (R?sel et al., 2012) is used as an observational constraint for the parameter estimation, which is provided by the Integrated Climate Data Center, University of Hamburg. The time range spans the warm season, 9 May to 6 September, from 2000 to 2011, with an interval of eight days. The spatial range is 180°W?180°E, 60°?90°N, with a spatial resolution of 12.5 km. The root mean square error (RMSE) of MODIS MPF is in the range of 3.8% to 11.2% compared to the in-situ validation data. MODIS is an optical sensor and could be affected by clouds. There are missing values north of 80°N in 2000, 2001, 2002, and 2007. Missing areas smaller than 12.5 km2 have been interpolated before the release of the data, but areas larger than 12.5 km2 have not been interpolated (R?sel and Kaleschke, 2012). The years with many missing values are avoided and 2005 is chosen for our parameter estimation using an adjoint model.
The sea ice concentration data used here is HadISST1 from the Met Office Hadley Centre (Rayner et al., 2003) for its accessibility and the convenience of data processing. HadISST1 integrates sea ice data from historical and satellite observations, providing global monthly sea ice concentrations with a spatial resolution of 1° × 1° since 1871. The sea ice thickness data used is based on upward-looking sonar observations collected by U.S. Navy submarines (Rothrock et al., 2008).

2
2.2. Atmospheric forcing
--> The JRA55-do data in 2005 derived from Japan Meteorological Agency (JMA) reanalysis JRA-55 is used as the atmospheric forcing data (Tsujino et al., 2018). This dataset is one of the default forcing datasets of CICE6.0. The data includes 10-m air temperature, 10-m specific humidity, 10-m wind velocity, downwelling shortwave flux, downwelling longwave flux, and precipitation with a temporal resolution of three hours. The variables are interpolated to a one-hour time step when used to force CICE6.0.

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2.3. Sea ice model CICE6.0 and melt pond parameterization scheme
--> In this study, the current version of the Los Alamos sea ice model, CICE6.0 is applied to simulate sea ice conditions at one point (Craig et al., 2018). CICE6.0 is a large-scale thermodynamic-dynamic model based on an ice thickness distribution function (Thorndike et al., 1975). It incorporates the parameterization of sub-grid mechanisms like sea ice ridging (Rothrock, 1975). The North Pole is displaced to land to avoid the singularity problem in computation. As a submodule of CICE6.0, the ICEPACK calculates the vertical sea ice physical and biogeochemical processes (Hunke et al., 2018). The ICEPACK updates the ice temperature by calculating the energy budget of the atmosphere-ice boundary layer and the ice-ocean boundary layer, and then determines the rate of ice growth or melting. CICE6.0 provides a separate driver routine to run the ICEPACK alone to simulate the sea ice state and its change at a single point. In this research, ICEPACK is used in estimating the melt pond parameter for both MYI and FYI.

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2.3.1. CESM melt pond parameterization scheme
--> The CESM melt pond scheme is one of the three parameterization schemes in CICE6.0, which is slightly different from the one developed in Holland et al. (2012). It calculates the area fraction and depth of melt ponds. The key point of this scheme is an assumed linear relationship between the pond depth and pond fraction,
Here, ${h_{\rm{p}}}$ is the average pond depth of an individual model grid. The ${\delta _{\rm{p}}}$ is the pond aspect ratio and ${a_{\rm{p}}}$ is the melt pond area fraction of this grid. The value of ${\delta _{\rm{p}}}$ is 0.8 in the default configuration of CICE6.0, which is an empirical relationship based on the SHEBA dataset (Perovich et al., 2003). The pond water comes from the meltwater of sea ice or snow and precipitation:
where ${v_{{\rm{p}},k}}$ is the volume of ponds at the $k$-th time step, ${\rho _{\rm{i}}}$ and ${\rho _{\rm{s}}}$ are the sea ice density and snow density, respectively, ${\rho _{\rm{w}}}$ is the meltwater density, and ${{f_{\rm{rain}}}}$ is the precipitation rate (kg m?2 s?1). $\Delta {h_{\rm{i}}}$ and $\Delta {h_{\rm{s}}}$ are the melt thicknesses of top sea ice and snow, respectively. Part of the meltwater would run away from the sea ice edge, cracks, and seal breathing holes. An empirical formula is used to calculate the proportion of the meltwater retained on sea ice, $r$:
Here ${a_{\rm{i}}}$ is the sea ice area concentration. This formula means that r is proportional to the sea ice area fraction in a grid cell because meltwater has a large chance to retain on the sea ice with a large area. In CICE6.0, the default values of ${r_{\min }}$ and ${r_{\max }}$ are 0.15 and 0.7, respectively. When the air temperature drops, the volume of the melt pond decreases as:
Here ${r_2}$= 0.01 is a constant coefficient. ${T_{\rm{p}}}$ is the reference temperature ?2°C. ${T_{{\rm{sfc}}}}$ is the sea ice surface temperature. This is also an empirical formula. When the sea ice surface temperature ${T_{{\rm{sfc}}}}$ is lower than the reference temperature ${T_{\rm{p}}}$ (i.e., the sea ice surface is cold enough), the melt pond volume begins to shrink. In this case, the melt pond water is not lost to the ocean and is converted to part of sea ice.
Once ${v_{{\rm{p}},k}}$ is calculated, the pond depth and fraction can be calculated following the relationship below:
Here ${h_{\rm{i}}}$ is the sea ice thickness. Eq. (6) is the method to compute melt pond depth. First, the melt pond depth is set to be proportional to the melt pond area fraction. Second, the melt pond depth is restricted to be less than 90 percent of the thickness of the corresponding ice category. The final melt pond depth is the smaller one of the two. The melt pond is not allowed to exist on ice thinner than 0.01 m in the CESM pond scheme:
This is physically reasonable because the melt pond on such thin sea ice will be lost to the ocean immediately.
The pond fraction and pond depth calculated here are later used in the calculation of albedo in the shortwave radiation scheme of the sea ice model, thus affecting the absorption of the radiation in the model and playing an important role in the sea ice simulation.

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2.4. Melt pond adjoint model and its verification
--> An adjoint model of the melt pond scheme is developed to estimate the pond aspect ratio as a parameter. To develop an adjoint model for an existing model, the first method is to find the analytic equations of the forward model and then derive the corresponding adjoint equations. An adjoint model is the discretization of these adjoint equations. The second method is more straightforward. It is to translate the source code of the forecast model to its adjoint code under the guidance of several rules. This process can be aided by automatic differential software tools (Utke et al., 2008). Automatic differential tools are designed to generate the adjoint model code automatically and are suitable for models developed with the concept of the adjoint in mind, such as the MITgcm. Because forward models are often too complex to isolate their analytic equations, the second method is more commonly used, with or without the aid of automatic differential tools. We adopt the second method, i.e., straightforward line-by-line code transformation to develop the adjoint code without using automatic differential tools. This is because CICE6.0 is complex and is not optimized in code structure for the automatic generation of the adjoint model.
The default value of the pond aspect ratio parameter in the CESM scheme is based on an empirical relation derived from the SHEBA observation for FYI. However, the Arctic sea ice is a mixture of MYI and FYI. Melt ponds on rough MYI tend to grow in the vertical direction rather than only in the horizontal direction. This is significantly different from the shallow and wide-spread ponds on flat FYI. Observations show that the MPF is closely related to the type of sea ice (Polashenski et al., 2012; Wang et al., 2017). Typically, the MPF on MYI is lower than that on FYI. The MPF on level FYI can be greater than 0.7, while the MPF on MYI is often lower than 0.4 (Perovich and Polashenski, 2012). Consequently, the pond aspect ratio parameter should be different for MYI and FYI. Therefore, it is necessary to develop an adjoint model of the melt pond scheme to estimate the aspect ratio parameter with the intent of finding a more suitable value.
The steps of developing the adjoint model are as follows. First, the input and output variables of the melt pond scheme are determined. The pond aspect ratio parameter ${\delta _{\rm{p}}}$ is selected as the input variable, thus the output variables are the ones that depend on the input variable, including the melt pond area fraction ${a_{\rm{p}}}$ and the melt pond depth ${h_{\rm{p}}}$. Second, the tangent linear model is constructed by a linearization of the forward melt pond scheme. Finally, the adjoint model is obtained by the transposition of the tangent linear model. The basic state, defined as the state variables calculated by the forward model using original parameters, is recalculated in the adjoint model for convenience instead of reading from the output of the forward model. The branches of the switched structures are linearized respectively. If the input variable appears in the judgment formula of the branch structure, its value from the forward model is used instead in the adjoint model. For each part of the forward model, the adjoint code is written separately and the complete adjoint model is composed of these adjoint codes in reverse order. The detailed guidance for adjoint model development can be found in the technical report of the MM5 (Mesoscale Model 5) adjoint model (Zou et al., 1997).
The correctness of the tangent linear model and adjoint model must be checked before their application. When a perturbation is sufficiently small, the perturbation of the model output from the tangent linear model integration should be very close to that calculated from the forward model integration. Accordingly, the following equation is used to check the correctness of the tangent linear model code:
where Q represents the forward model, z is the input variable vector of Q, and h is a perturbation added to the input variable. P is the tangent linear model, $\alpha $ is a scaling factor. Eq. (8) indicates that R should approach 1 as $\alpha $ approaches zero. In practice, h should be small enough such that its high-order terms can be ignored but larger than the rounding error of the machine. The adjoint model is checked following the equation below:
where P represents the tangent linear model. The ${\rm{d}}{{z}}$ is the input variable vector of P and ${{{P}}^{\rm{T}}}$ represents the adjoint model. Run the tangent linear model with ${\rm{d}}{{z}}$ as input to acquire ${{P}} \cdot {\rm{d}}{{z}}$. Run the adjoint model with ${{P}} \cdot {\rm{d}}{{z}}$ as input to acquire ${{{P}}^{\rm{T}}} \cdot {{P}} \cdot {\rm{d}}{{z}}$. The operation symbol < > represents the inner product of a vector. The adjoint model code passes the correctness check if Eq. (9) holds true within the accuracy of the machine.
The tangent linear model is checked following Eq. (8). The settings of the scale factor $\alpha $ and perturbation h are shown in Table 1. First, the forward model is run using the default value of the parameter ${\delta _{\rm{p}}}$ to obtain Q (z). Then a perturbation of the size $\alpha {{h}}$ is added to the parameter ${\delta _{\rm{p}}}$ to run the forward model to obtain ${{Q}}({{z}} + \alpha {{h}})$. The result is shown in Fig. 1. As $\alpha $ approaches zero, R approaches 1. This indicates that the code of the tangent linear model is correct.
Case$\alpha $h
11.00.2
20.90.2
30.80.2
40.70.2
50.60.2
60.50.2
70.40.2
80.30.2
90.20.2
100.10.2


Table1. The setup of the correctness check of the tangent linear model and adjoint model. $ \alpha $ is the scaling factor, h is the perturbation of the input vector.


Figure1. Correctness check of CESM melt pond scheme tangent linear model.


The adjoint model is checked following Eq. (9). Here ${\rm{d}}{{z}}$ is set to $\alpha {{h}}$. The settings of the scale factor $\alpha $ and perturbation h are the same as shown in Table 1. The tangent linear model is run to obtain ${{P}} \cdot {\rm{d}}{{z}}$. Utilizing ${{P}} \cdot {\rm{d}}{{z}}$ as the input, the adjoint model is run to obtain ${{{P}}^{\rm{T}}} \cdot {{P}} \cdot {\rm{d}}{{z}}$. The result is shown in Fig. 2. As $\alpha $ approaches zero, the difference of the left-hand side term and the right-hand side term approaches zero. This indicates that the code of the adjoint model is correct.
Figure2. Correctness check of CESM melt pond scheme adjoint model.



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2.5. Parameter estimation and L-BFGS scheme
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2.5.1. Parameter estimation algorithm
--> To estimate the melt pond scheme parameter, an effective algorithm is constructed. The framework of the algorithm is designed as follows. The workflow of the parameter estimation algorithm is shown in Fig. 3. Step 1, a first-guess value of the parameter is set. Step 2, the forward model is integrated to acquire and save the basic state of the pond. At the same time, the melt pond intermediate forcing is saved to drive the melt pond adjoint model at a later time. Step 3, the cost function is calculated according to Eq. (11) using the MPF from the model and observations. Step 4, the adjoint model is integrated under the intermediate melt pond forcing data to acquire the trajectory of the adjoint state variable. Step 5, the gradient of the cost function is calculated. Step 6, the calculated cost function and gradient are sent to the L-BFGS minimization algorithm. The minimization algorithm then automatically adjusts the step size, updates the estimated value of the parameter, and determines whether the specified termination conditions of the iteration are satisfied. If the termination conditions are satisfied, the program will be terminated and return the final estimation of the parameter. Otherwise, the latest estimated value of the parameter will be used as input for step 2 to start a new iteration cycle. When the difference of the estimated parameters from two consecutive iterations is less than a tolerance constant of 10?16 or the norm of cost function gradient $\left\| {{{{\nabla}} _X}J} \right\|$ is less than the minimum between $\varepsilon $ and $\varepsilon \left\| {{X}} \right\|$, the iteration will stop. Here, $\varepsilon $ is set to 10?5, $\left\| {{X}} \right\|$ is the norm of the estimated parameter.
Figure3. Flow chart of the melt pond parameter estimation algorithm.



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2.5.2. L-BFGS minimalization algorithm
--> The parameter estimation could be accomplished by combing the forward model, the adjoint model, and a minimization algorithm. The L-BFGS minimization algorithm is used in our melt pond scheme parameter estimation. It is a quasi-Newtonian method and is widely used in large-scale optimization problems (Liu and Nocedal, 1989). The algorithm updates the parameters according to the following formula:
where ${{{X}}_k}$ is the value of the estimated parameter vector in the k-th iteration and ${{{\nabla}} _{{X}}}{J_k}$ is the gradient vector of the cost function J in the k-th iteration. ${\rho _k}$ is the step size of the k-th iteration and is automatically adjusted by the minimization algorithm.
Since we aim to estimate the melt pond aspect ratio, the cost function is set as:
Here J is the cost function, ${a_{{\rm{p,o}},i}}$ is the MODIS MPF at the i-th observation time point, and ${a_{{\rm{p,m}},i}}$ is the simulated MPF at the i-th observation time. N is the number of observations. The cost function J represents the root-mean-square difference between the model and the observation. When the cost function reaches its minimum, the estimated value of the parameter is obtained. There are some cases that the cost function reaches a minimum with a negative pond aspect ratio. For such rare cases, the default pond aspect ratio is used.

3. Results and Discussion
2
3.1. Melt pond parameter estimation algorithm verification
--> To verify the parameter estimation algorithm, an ideal experiment method is adopted similarly to previous work (Cao et al., 2011). In the ideal experiment, a forward model integration is carried out using a given parameter and the output of MPF from the forward model is saved as “observation” data. Then the “observation” data is used as the observational constraint of the parameter estimation algorithm. The given pond aspect ratio parameter δp value of 0.8 is the default value used in CICE6.0. The first-guess of the parameter is set to be 0.6. The verification is aimed to examine whether the parameter estimation algorithm can obtain a value of 0.8.
The program terminates after seven iterations. The estimated value of the parameter is 0.8. As shown in Fig. 4a, after five iterations, the estimated value of the parameter is already very close to the given value of 0.8. Figure 4b shows the change of cost function J in iterations. The cost function quickly descends to zero after 3 iterations. Figure 4c is the change of norm of the cost function gradient $\left\| {{{\nabla}} J} \right\|$ with iteration numbers. The norm of cost function gradient is represented here as ${\left\| {{{\nabla}} J} \right\|^{\rm{2}}}{\rm{ = }}{\left({\partial J/\partial {\delta _{\rm{p}}}} \right)^2}$. The norm of the gradient approaches zero after five iterations, indicating that the cost function has reached its extreme value.
Figure4. Evolution of the (a) the pond aspect ratio parameter, (b) cost function, and (c) norm of cost function gradient with iteration number in the parameter estimation process.


A series of numeric experiments are carried out to examine the influence of the first-guess on parameter estimation results. The result is shown in Table 2, indicating that under different first-guess values, the “correct” parameter estimation of 0.8 can be obtained by the parameter estimation algorithm. Meanwhile, the iteration number in each experiment is less than 10. This shows that the algorithm has high computational efficiency. The above calculation verifies the melt pond adjoint model and parameter estimation algorithm. The results show that they are both correct and effective.
CaseGiven ${\delta _{\rm{p}}}$First-guess ${\delta _{\rm{p}}}$Estimated ${\delta _{\rm{p}}}$Iteration number
10.80.10.88
20.80.20.87
30.80.30.89
40.80.40.88
50.80.50.86
60.80.60.87
70.80.70.85
80.80.90.87
90.81.00.87


Table2. Results of melt pond parameter estimation under different first-guess values.



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3.2. Parameter estimation in Arctic regions
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3.2.1. Regions
--> In this section, the parameter estimation is conducted in representative regions of MYI and FYI, respectively. Based on the HadISST1 sea ice concentration data, the MYI region is identified as the region that is covered by sea ice from March to September, while FYI is the region that is covered by sea ice in March and becomes ice-free in September. Figure 5 is the spatial distribution of monthly sea ice concentration in March and September of 2005. The loss of sea ice is most serious in September in the Arctic marginal sea with little to no ice left north of Russia. MODIS data has missing values due to cloud and fog. So, we choose to analyze regions that have fewer missing values to avoid this disadvantage. For the parameter estimation in the later section, the MYI region is chosen to be north of the Canadian Arctic Archipelago (120°W, 80°N). The FYI region is chosen to be in the Kara Sea (90°E, 78°N). The MYI region has one missing time point out of 16 time points while the FYI region has three missing time points out of 16 time points.

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3.2.2. Parameter estimation periods
--> During the evolution of melt ponds, the change of pond area fraction and pond depth are not synchronous (Eicken et al., 2002). In the first stage of the melt pond evolution, pond fraction increases quickly and the pond aspect ratio remains small; in the second stage, the loss of meltwater from the bottom of sea ice increases and results in a greater pond aspect ratio. In the third stage, the moderately rising pond coverage and stable pond depth reduce the pond aspect ratio. Therefore, for different stages of pond evolution, different pond aspect ratio parameters should be used in the melt pond scheme.
Starting from 9 May and ending 6 September, the summertime MODIS observations are divided into 15 periods with each period containing eight days. The parameter is estimated in each period. The MODIS observations are interpolated to a 1-hour interval before parameter estimation for comparison with model output. After interpolation, no missing value is left in the 1-hour MODIS MPF data. The cost function is then defined as the discrepancy between the 1-hour simulation and observations. In the model integration, for each period, we first estimate the melt pond parameter and use it in simulation. Then the simulation outputs at the end of current period are used as the initial condition for the forward model integration of next period. The process of parameter estimation is introduced in section 2.5 and Fig. 3. The MODIS observation is used to constrain the optimization.

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3.2.3. Model configuration
--> The integration time of the model is from 1 January 2005 to 1 January 2016 with a time step of 3600 seconds. The Bitz-Lipscomb scheme (Bitz and Lipscomb, 1999), Delta-Eddington scheme (Briegleb and Light, 2007), and CESM scheme are selected as the parameterization schemes for the thermodynamic, short-wave radiation, and melt ponds. Other parameters are set to the default values in the CICE6.0 model. CICE6.0 adopts an ice thickness distribution function to describe the sub-grid scale variation of sea ice thickness. The ice thickness distribution used here has five thickness categories shown in Table 3. HadISST1 sea ice concentration data and US army submarine ice thickness data are used to establish initial conditions. The initial sea ice concentration of MYI is set to 100% according to the nearest HadISST1 data and the initial average ice thickness is set to 2.79 m according to the nearest submarine data, while they are 100% and 1.80 m for FYI. The initial MPF and melt pond depth for both MYI and FYI are 0% and 0 m, respectively.
CategoryLower bound (m)Upper bound (m)
10.000.60
20.601.40
31.402.40
42.403.60
53.605.00


Table3. Setup of the ice thickness distribution in experiments.


Figure5. Sea ice concentration of (a) March 2005 and (b) September 2005. The white-filled square in (b) represents the MYI study region and the white hollow square represents the FYI study region.



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3.2.4. Parameter estimation for multi-year ice region
--> Figure 6a presents the estimated values of the pond aspect ratio parameter for the MYI region. This estimated parameter has a large temporal variation. At the early stage of the melting season, from 9 May to 2 June, the parameter value is relatively large. From 2 June to 26 June, the parameter value drops to around 1. From 26 June to 29 August, the parameter value further, and profoundly, drops to below 0.05. From 29 August to 6 September, the parameter value rises to the default value of 0.8. Overall, the estimated parameter on the MYI region has a descending trend during the melting season. At the early stage of melt pond development, i.e., from 9 May to 26 June, even though there is a large difference in the estimated and default aspect ratio, the simulations of MPF and depth have only minor differences (Figs. 6b and 6c). At this stage, the melt pond volume is small and the simulation difference is also minor. In contrast, from 26 June to 13 August, the simulation of MPF using the default parameter is smaller compared with MODIS observation especially from 30 June to 20 July (blue and black line in Fig. 6b). During these 20 days, the observed MPF (black line in Fig. 6b) is higher than 20%, however, the simulated pond fraction is nearly zero. The increase of pond fraction in the observations is not captured by the simulation. Overall, the RMSE (Root Mean Square Error) of the simulation using the default parameter is 16.69% compared with the observations.
Figure6. (a) The estimated and default aspect ratio for the multi-year ice region. (b) Comparison of MODIS observed melt pond fraction (black solid line; units: %) and the simulation using the estimated (red solid line; units: %) and default aspect ratio (blue solid line; units: %). (c) Comparison of melt pond depth using the estimated (red solid line; units: m) and default aspect ratio (blue solid line; units: m).


The parameter estimation algorithm adjusts the pond aspect ratio parameter continuously to reduce the error of the simulation. In July and August, the simulated MPF using the default parameter is much lower than the observations, and the estimated pond aspect ratio is much smaller than the default value. By using a reduced aspect ratio, the simulated MPF (red line in Fig. 6b) is enhanced and much closer to MODIS observation. This may be explained in the framework of the CESM melt pond scheme. Assuming the meltwater volume remains the same for both the default parameter and the estimated parameter simulation, any reduction of aspect ratio would reduce the depth of the melt pond and enhance the MPF according to Eq. (5). Comparing the simulated melt pond depth with the estimated and default parameter shown in Fig. 6c, it is clear that during the period from 26 June to 13 August when the estimated parameter is reduced, the melt pond depth simulation is enhanced. It is obvious that using the estimated parameter reduces the simulation error of the MPF, whose RMSE is reduced to 7.19%. However, not all the simulations in each period can be improved. For instance, after 13 August, there is no improvement using the estimated parameter. It might indicate that other parameters can have a greater impact on the melt pond evolution at this time. For example, extremely low air temperature would cause the melt pond volume to shrink. In this case, it is not enough to adjust only the pond aspect ratio parameter.

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3.2.5. Parameter estimation for first-year ice region
--> For the first-year ice region, the estimated parameter can also improve the MPF simulation. Figure 7a presents the estimated values of the pond aspect ratio parameter on the FYI region. The estimated parameter has a large temporal variation. From 9 May to 18 June, the parameter value is relatively small. From 18 June to 6 September, the estimated parameter value is larger than 10 and remains relatively stable. The large estimated parameter on FYI is probably due to the higher simulated MPF using the default parameter (blue line in Fig. 7b). Compared with MODIS observations, the simulation using the default parameter is quite different and much larger than the observation. After 20 June, while the observed MPF is nearly 0%, the simulated pond fraction using the default value is higher than 15%. The duration of melt ponds is too long given that the MPF is still higher than 20% in early September. The RMSE of the MPF simulation is 6.31%. The simulated MPF using the estimated parameter is decreased and is closer to the MODIS observations. The RMSE is reduced to 4.60%. Using the estimated parameter can reduce the simulation error of MPF. Note that not all the simulation results at each period can be improved. For instance, after June 18, the observed pond fraction drops to zero. The simulated pond fraction fails to capture this observational feature. This indicates that FYI in this region may melt away completely. Although the estimated melt pond parameters are used, this simulation error cannot be eliminated, which shows the limitation of adjusting only one parameter in the melt pond scheme.
Figure7. (a) The estimated and default aspect ratio for the first-year ice region. (b) Comparison of MODIS observed melt pond fraction (black solid line; units: %) and the simulation using the estimated (red solid line; units: %) and default aspect ratio (blue solid line; units: %). (c) Comparison of melt pond depth using the estimated (red solid line; units: m) and default aspect ratio (blue solid line; units: m).


The adjustment of aspect ratio also causes a change in the melt pond depth simulation consistent with the framework of the CESM melt pond scheme. Figure 7c shows a comparison between the simulated melt pond depth using the estimated parameter and the simulated melt pond depth using the default parameter. Large adjustments of aspect ratio occur from mid-June to the beginning of September. The adjustment of aspect ratio results in reducing the MPF compared to that which is predicted by the simulation which uses the default aspect ratio. By increasing the aspect ratio, the MPF is reduced and much closer to MODIS observation (Fig. 7b). The simulated depth of melt ponds is increased compared with the case using the default aspect ratio since the melt pond volume remains the same for both cases.

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3.2.6. Discussion of MYI and FYI results
--> The estimated parameter of FYI is quite different from that of MYI. Previous work has found that the spatio-temporal variable parameters estimated by the adjoint method are more suitable to the simulation of marine ecological models, in contrast to the constant parameters or parameters that only change in space or time (Li et al., 2014). For the melt pond aspect ratio parameter, due to the strong variability of the melt pond process, the spatio-temporal variable parameter may be more reasonable.
In general, one would expect that the melt pond aspect ratio for FYI should be lower than that of the MYI, opposite from the result in Fig. 6 and Fig. 7. This may point to the questionable representativeness of the MYI and FYI region selected in our study and the limitation of adjusting only one model parameter. Since only pond aspect ratio is adjusted by the adjoint model, when the simulation using the default parameter is different from the observation, the adjoint model will provide an estimated aspect ratio such that the new simulation is closer to observation. If the other parameter, such as $r$ in Eq. (3) can be adjusted, the simulation can also be adjusted to be closer to observation by varying the meltwater volume retained on sea ice. This points to the limitations of the adjoint model method, which works within the framework of the forward model.
For both the MYI and FYI region, the parameter estimation algorithm presented in section 2.5 can derive an estimated aspect ratio that can improve the MPF simulation as expected. The adjustment of aspect ratio and the simulation of MPF and depth are consistent in the framework of CESM scheme. However, for both the MYI and FYI regions, there are periods that the adjustment of aspect ratio does not improve the MPF simulation significantly. This may be explained by the fact that the development and temporal evolution of melt ponds are influenced by many factors. Adjusting the aspect ratio has its limitations in improving melt pond simulations.

4. Conclusions
There are many empirical parameters in the melt pond parameterization scheme in sea ice models. The adjoint model can be used to estimate these parameters to reduce their uncertainty. In this work, a parameter estimation of the CESM melt pond scheme in CICE6.0 is carried out using its adjoint model. First, the adjoint model is directly built from the forward model code following the general rules of adjoint code generation. Second, the melt pond parameter estimation algorithm is constructed and has been verified under ideal conditions. Finally, the pond parameter for Arctic MYI and FYI region in different summer periods is estimated using MODIS data as the observational constraint. The main conclusions are as follows.
(1) The direct code transformation method adopted here can correctly obtain the tangent linear model and adjoint model of the melt pond parameterization scheme. The cost function gradient is calculated correctly using the adjoint model. The parameter estimation algorithm composed of the forward model, the adjoint model, and the minimization algorithm is effective in parameter estimation of the CESM melt pond scheme in CICE6.0.
(2) The estimated parameter varies with time and space. This is different from the default fixed parameter in CICE6.0. The estimated parameter values on the MYI and FYI regions during different periods of Arctic summer are quite different. This could be closely related to the strong variability of melt ponds on sea ice.
(3) When used in the simulation, the estimated parameter reduces the simulation error of MPF significantly. In the case study, compared with the experiments using the default parameter, the experiments using the estimated parameter have less RMSE compared with MODIS observations in terms of MPF.
The melt pond behavior involves a complex mechanism that is affected by multiple variables such as radiation, air temperature, precipitation, and sea ice surface topography, etc. In this paper, an adjoint model of the CESM melt pond scheme is developed to estimate the pond aspect ratio parameter. The results prove the feasibility of applying the adjoint model in melt pond parameter estimation. This work provides a foundation for future applications of the adjoint model concerning the estimation of other parameters in melt pond schemes. The melt pond aspect ratio determines the partitioning of meltwater volume between melt pond area and depth. Although this is an important parameter, other parameters cannot be ignored. For instance, the meltwater retaining fraction can directly affect the melt pond volume. Due to complex interactions between physical processes, the adjoint model should be further improved to include more parameters. Multiple parameters should be estimated simultaneously to achieve optimization of the model. Besides, the CESM scheme is relatively simple. Developing an adjoint model for melt pond schemes that have a more complete physical basis and using it to provide parameter estimation would improve the description of melt ponds in sea ice models and ultimately improve their performance. Furthermore, when using an adjoint model to estimate model parameters, the framework of the forward model is accepted as a precondition. This is a limitation of the adjoint model method. More physical consideration should be included to help improve the framework of numeric models and schemes.
Acknowledgments. This research was funded by the National Key R&D Program of China (Grant No. 2018YFA0605904). We thank the CliSAP-Integrated Climate Data Center, University of Hamburg for their online publication of MODIS melt pond data. The comments and suggestions from reviewers and editors helped us greatly in improving the manuscript.

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