Making deep learning practical for Earth system forecasting

Novel “cuboid attention” helps transformers handle large-scale multidimensional data, while diffusion models enable probabilistic prediction.

The Earth is a complex system. Variabilities ranging from regular events like temperature fluctuations to extreme events like drought, hailstorms, and the El Niño–Southern Oscillation (ENSO) phenomenon can influence crop yields, delay airline flights, and cause floods and forest fires. Precise and timely forecasting of these variabilities can help people take necessary precautions to avoid crises or better utilize natural resources such as wind and solar energy.

The success of transformer-based models in other AI domains has led researchers to attempt applying them to Earth system forecasting, too. But these efforts have encountered several major challenges. Foremost among these is the high dimensionality of Earth system data: naively applying the transformer’s quadratic-complexity attention mechanism is too computationally expensive.

Most existing machine-learning-based Earth systems models also output single, point forecasts, which are often averages across wide ranges of possible outcomes. Sometimes, however, it may be more important to know that there’s a 10% chance of an extreme weather event than to know the general averages across a range of possible outcomes. And finally, typical machine learning models don’t have guardrails imposed by physical laws or historical precedents and can produce outputs that are unlikely or even impossible.

In recent work, our team at Amazon Web Services has tackled all these challenges. Our paper “Earthformer: Exploring space-time transformers for Earth system forecasting”, published at NeurIPS 2022, suggests a novel attention mechanism we call cuboid attention, which enables transformers to process large-scale, multidimensional data much more efficiently.

And in “PreDiff: Precipitation nowcasting with latent diffusion models”, to appear at NeurIPS 2023, we show that diffusion models can both enable probabilistic forecasts and impose constraints on model outputs, making them much more consistent with both the historical record and the laws of physics.

Earthformer and cuboid attention

The heart of the transformer model is its “attention mechanism”, which enables it to weigh the importance of different parts of an input sequence when processing each element of the output sequence. This mechanism allows transformers to capture spatiotemporally long-range dependencies and relationships in the data, which have not been well modeled by conventional convolutional-neural-network- or recurrent-neural-network-based architectures.

Earth system data, however, is inherently high-dimensional and spatiotemporally complex. In the SEVIR dataset studied in our NeurIPS 2022 paper, for instance, each data sequence consists of 25 frames of data captured at five-minute intervals, each frame having a spatial resolution of 384 x 384 pixels. Using the conventional transformer attention mechanism to process such high-dimensional data would be extremely expensive.

In our NeurIPS 2022 paper, we proposed a novel attention mechanism we call cuboid attention, which decomposes input tensors into cuboids, or higher-dimensional analogues of cubes, and applies attention at the level of each cuboid. Since the computational cost of attention scales quadratically with the tensor size, applying attention locally in each cuboid is much more computationally tractable than trying to compute attention weights across the entire tensor at once. For instance, decomposing along the temporal axis can result in cost reduction by a factor of 3842 for the SEVIR dataset, since each frame has a spatial resolution of 384 x 384 pixels

Of course, such decomposition introduces a limitation: attention functions independently within each cuboid, with no communication between cuboids. To address this issue, we also compute global vectors that summarize the cuboids’ attention weights. Other cuboids can factor the global vectors into their own attention weight computations.

cuboid_illustration.gif
Cuboid attention layer processing an input tensor (X) with global vectors (G).

We call our transformer-based model with cuboid attention Earthformer. Earthformer adopts a hierarchical encoder-decoder architecture, which gradually encodes the input sequence to multiple levels of representations and generates the prediction via a coarse-to-fine procedure. Each hierarchy includes a stack of cuboid attention blocks. By stacking multiple cuboid attention layers with different configurations, we are able to efficiently explore effective space-time attention.

earthforer_enc_dec.png
The Earthformer architecture is a hierarchical transformer encoder-decoder with cuboid attention. In this diagram, “×D” means to stack D cuboid attention blocks with residual connections, while “×M” means to have M layers of hierarchies.

We experimented with multiple methods for decomposing an input tensor into cuboids. Our empirical studies show that the “axial” pattern, which stacks three unshifted local decompositions along the temporal, height, and width axes, is both effective and efficient. It achieves the best performance while avoiding the exponential computational cost of vanilla attention.

cub_pattern_together.png
Illustration of cuboid decomposition strategies when the input shape is (T, H, W) = (6, 4, 4), and cuboid size is (3, 2, 2). Elements that have the same color belong to the same cuboid and will attend to each other. Local decompositions aggregate contiguous elements of the tensor, and dilated decompositions aggregate elements according to a step function determined by the cuboid size. Both local and dilated decompositions, however, can be shifted by some number of elements along any of the tensor’s axes.

Experimental results

To evaluate Earthformer, we compared it to six state-of-the-art spatiotemporal forecasting models on two real-world datasets: SEVIR, for the task of continuously predicting precipitation probability in the near future (“nowcasting”), and ICAR-ENSO, for forecasting sea surface temperature (SST) anomalies.

On SEVIR, the evaluation metrics we used were standard mean squared error (MSE) and critical success index (CSI), a standard metric in precipitation nowcasting evaluation. CSI is also known as intersection over union (IoU): at different thresholds, it's denoted as CSI-thresh; their mean is denoted as CSI-M.

On both MSE and CSI, Earthformer outperformed all six baseline models across the board. Earthformer with global vectors also uniformly outperformed the version without global vectors.

Model
#Params.(M)
GFLOPS
Metrics
CSI-M↑
CSI-219↑
CSI-181↑
MSE(10-3)↓
Persistence
-
-
0.2613
0.0526
0.0969
11.5338
UNet
16.6
33
0.3593
0.0577
0.1580
4.1119
ConvLSTM
14.0
527
0.4185
0.1288
0.2482
3.7532
PredRNN
46.6
328
0.4080
0.1312
0.2324
3.9014
PhyDNet
13.7
701
0.3940
0.1288
0.2309
4.8165
E3D-LSTM
35.6
523
0.4038
0.1239
0.2270
4.1702
Rainformer
184.0
170
0.3661
0.0831
0.1670
4.0272
Earthformer w/o global
13.1
257
0.4356
0.1572
0.2716
3.7002
Earthformer
15.1
257
0.4419
0.1791
0.2848
3.6957

On ICAR-ENSO, we report the correlation skill of the three-month-moving-averaged Nino3.4 index, which evaluates the accuracy of SST anomaly prediction across a certain area (170°-120°W, 5°S-5°N) of the Pacific. Earthformer consistently outperforms the baselines in all concerned evaluation metrics, and the version using global vectors further improves performance.

Model
#Params.(M)
GFLOPS
Metrics
C-Nino3.4-M↑
C-Nino3.4-WM↑
MSE(10-4)↓
Persistence
-
-
0.3221
0. 447
4.581
UNet
12.1
0.4
0.6926
2.102
2.868
ConvLSTM
14.0
11.1
0.6955
2.107
2.657
PredRNN
23.8
85.8
0.6492
1.910
3.044
PhyDNet
3.1
5.7
0.6646
1.965
2.708
E3D-LSTM
12.9
99.8
0.7040
2.125
3.095
Rainformer
19.2
1.3
0.7106
2.153
3.043
Earthformer w/o global
6.6
23.6
0.7239
2.214
2.550
Earthformer
7.6
23.9
0.7329
2.259
2.546

PreDiff

Diffusion models have recently emerged as a leading approach to many AI tasks. Diffusion models are generative models that establish a forward process of iteratively adding Gaussian noise to training samples; the model then learns to incrementally remove the added noise in a reverse diffusion process, gradually reducing the noise level and ultimately resulting in clear and high-quality generation.

During training, the model learns a sequence of transition probabilities between each of the denoising steps it incrementally learns to perform. It is therefore an intrinsically probabilistic model, which is well suited for probabilistic forecasting.

A recent variation on diffusion models is the latent diffusion model: before passing to the diffusion model, an input is first fed to an autoencoder, which has a bottleneck layer that produces a compressed embedding (data representation); the diffusion model is then applied in the compressed space.

In our forthcoming NeurIPS paper, “PreDiff: Precipitation nowcasting with latent diffusion models”, we present PreDiff, a latent diffusion model that uses Earthformer as its core neural-network architecture.

By modifying the transition probabilities of the trained model, we can impose constraints on the model output, making it more likely to conform to some prior knowledge. We achieve this by simply shifting the mean of the learned distribution, until it complies better with the constraint we wish to impose. 

prediff_overview_new_v1.png
An overview of PreDiff. The autoencoder (e) encodes the input as a latent vector (zcond). The latent diffusion model, which adopts the Earthformer architecture, then incrementally denoises (steps zt+1 to z0) the noisy version of the input (zT). In the knowledge control step, the transition distributions between denoising steps are modified to accord with prior knowledge.

Results

We evaluated PreDiff on the task of predicting precipitation intensity in the near future (“nowcasting”) on SEVIR. We use anticipated precipitation intensity as a knowledge control to simulate possible extreme weather events like rainstorms and droughts.

We found that knowledge control with anticipated future precipitation intensity effectively guides generation while maintaining fidelity and adherence to the true data distribution. For example, the third row of the following figure simulates how weather unfolds in an extreme case (with probability around 0.35%) where the future average intensity exceeds μτ + 4στ. Such simulation can be valuable for estimating potential damage in extreme-rainstorm cases.

nbody_vis_v6.png
A set of example forecasts from PreDiff with knowledge control (PreDiff-KC), i.e., PreDiff under the guidance of anticipated average intensity. From top to bottom: context sequence y, target sequence x, and forecasts from PreDiff-KC showcasing different levels of anticipated future intensity τ + nστ), where n takes the values −4, −2, 0, 2, and 4.

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Are you looking to work at the forefront of Machine Learning and AI? Would you be excited to apply cutting edge Generative AI algorithms to solve real world problems with significant impact? The Generative AI Innovation Center at AWS is a new strategic team that helps AWS customers implement Generative AI solutions and realize transformational business opportunities. This is a team of strategists, data scientists, engineers, and solution architects working step-by-step with customers to build bespoke solutions that harness the power of generative AI. The team helps customers imagine and scope the use cases that will create the greatest value for their businesses, select and train and fine tune the right models, define paths to navigate technical or business challenges, develop proof-of-concepts, and make plans for launching solutions at scale. The GenAI Innovation Center team provides guidance on best practices for applying generative AI responsibly and cost efficiently. You will work directly with customers and innovate in a fast-paced organization that contributes to game-changing projects and technologies. You will design and run experiments, research new algorithms, and find new ways of optimizing risk, profitability, and customer experience. We’re looking for Data Scientists capable of using GenAI and other techniques to design, evangelize, and implement state-of-the-art solutions for never-before-solved problems. Sales, Marketing, and Global Services (SMGS) is responsible for driving revenue, adoption, and growth from the largest and fastest growing small- and mid-market accounts to enterprise-level customers including public sector. The AWS Global Support team interacts with leading companies and believes that world-class support is critical to customer success. AWS Support also partners with a global list of customers that are building mission-critical applications on top of AWS services. Key job responsibilities As an Data Scientist, you will * Collaborate with AI/ML scientists and architects to Research, design, develop, and evaluate cutting-edge generative AI algorithms to address real-world challenges * Interact with customers directly to understand the business problem, help and aid them in implementation of generative AI solutions, deliver briefing and deep dive sessions to customers and guide customer on adoption patterns and paths to production * Create and deliver best practice recommendations, tutorials, blog posts, sample code, and presentations adapted to technical, business, and executive stakeholder * Provide customer and market feedback to Product and Engineering teams to help define product direction About the team About AWS Diverse Experiences AWS values diverse experiences. Even if you do not meet all of the qualifications and skills listed in the job description, we encourage candidates to apply. If your career is just starting, hasn’t followed a traditional path, or includes alternative experiences, don’t let it stop you from applying. Why AWS? Amazon Web Services (AWS) is the world’s most comprehensive and broadly adopted cloud platform. We pioneered cloud computing and never stopped innovating — that’s why customers from the most successful startups to Global 500 companies trust our robust suite of products and services to power their businesses. Inclusive Team Culture Here at AWS, it’s in our nature to learn and be curious. Our employee-led affinity groups foster a culture of inclusion that empower us to be proud of our differences. Ongoing events and learning experiences, including our Conversations on Race and Ethnicity (CORE) and AmazeCon (gender diversity) conferences, inspire us to never stop embracing our uniqueness. Mentorship & Career Growth We’re continuously raising our performance bar as we strive to become Earth’s Best Employer. That’s why you’ll find endless knowledge-sharing, mentorship and other career-advancing resources here to help you develop into a better-rounded professional. Work/Life Balance We value work-life harmony. Achieving success at work should never come at the expense of sacrifices at home, which is why flexible work hours and arrangements are part of our culture. When we feel supported in the workplace and at home, there’s nothing we can’t achieve in the cloud We are open to hiring candidates to work out of one of the following locations: Arlington, VA, USA | Atlanta, GA, USA | Boston, MA, USA | Houston, TX, USA | Miami, FL, USA | New York, NY, USA | San Diego, CA, USA | Seattle, WA, USA | Sunnyvale, CA, USA
US, WA, Seattle
Amazon.com’s Buyer Risk Prevention's (BRP) mission is to make Amazon the safest and most trusted place worldwide to transact online. BRP safeguards every financial transaction across all Amazon sites. As such, BRP designs and builds the software systems, risk models, and operational processes that minimize risk and maximize trust in Amazon.com. The BRP organization is looking for an Applied Scientist for the Buyer Abuse team, whose mission is to combine advanced analytics with investigator insight to create mechanisms to proactively and reactively reduce the impact of abuse across Amazon. Key job responsibilities As an Applied Scientist, you will be responsible for modeling complex problems, discovering insights, and building cutting edge risk algorithms that identify opportunities through statistical models, machine learning, and visualization techniques to improve operational efficiency and reduce monetary losses and improve customer trust. You will need to collaborate effectively with business and product leaders within BRP and cross-functional teams to build scalable solutions against high organizational standards. The candidate should be able to apply a breadth of tools, data sources, and ML techniques to answer a wide range of high-impact business questions and proactively present new insights in concise and effective manner. The candidate should be an effective communicator capable of independently driving issues to resolution and communicating insights to non-technical audiences. This is a high impact role with goals that directly impacts the bottom line of the business. Responsibilities: - Invent, implement, and deploy state of the art machine learning algorithms and systems - Build prototypes and explore conceptually new solutions - Define and conduct experiments to validate/reject hypotheses, and communicate insights and recommendations to Product and Tech teams - Take ownership of how ML solutions impact Amazon resources and Customer experience - Develop efficient data querying infrastructure for both offline and online use cases - Collaborate with cross-functional teams from multidisciplinary science, engineering and business backgrounds to enhance current automation processes - Learn and understand a broad range of Amazon’s data resources and know when, how, and which to use and which not to use. - Research and implement novel machine learning and statistical approaches - Maintain technical document and communicate results to diverse audiences with effective writing, visualizations, and presentations Please visit https://www.amazon.science for more information We are open to hiring candidates to work out of one of the following locations: San Diego, CA, USA | Seattle, WA, USA
US, WA, Seattle
Are you interested in big data, machine learning, LLM, and product recommendations? If so, Amazon's Personalization team might be the right place for you. About our organization: We are part of Amazon’s Personalization organization, a high-performing group with a huge impact on hundreds of millions of customers, innovating at the intersection of customer experience, machine learning, and large-scale distributed systems. We run global experiments and our work has revolutionized e-commerce with features such as "Compare with similar items", "Keep shopping for ...", “Customers who bought this item also bought”, and, “Frequently bought together” among others. Amazon’s internal surveys regularly recognize us as one of the best organizations to work for in the company, with visible high-impact work, low operational load, respectful work-life balance, and continual opportunity to learn and grow. About you: You are a Sr. Applied Scientist who love big data and passionate about improving customer shopping experience by inventing and applying state-of-art technologies (e.g., LLM, Machine Learning, NLP, and Computer Vision) to build the next-generation product recommendation engine for Amazon. You have an entrepreneurial spirit, know how to deliver, are deeply technical and highly innovative. You work closely with software engineers to put algorithms into production. You also work in partnership with teams across Amazon to create enormous benefits for our customers. You will have an opportunity to make an enormous impact on the design, architecture, and implementation of cutting edge products used every day by people you know. Key job responsibilities - Use machine learning and analytical techniques to create scalable solutions for business problems - Analyze and extract relevant information from large amounts of Amazon's historical business data to help automate and optimize key processes - Design, development and evaluation of highly innovative models for predictive learning - Work closely with software engineering teams to drive model implementations and new feature creations - Establish scalable, efficient, automated processes for large scale data analyses, model development, model validation and model implementation - Research and implement novel machine learning and statistical approaches - Mentor junior scientists; review their work and provide feedback About the team Our mission is to delight every Amazon customer with a personalized shopping experience. We achieve our mission through investments in large-scale machine learning and distributed system solutions with the purpose of delivering the future of shopping on Amazon. Our solutions help customers explore product categories, discover high quality products that meet their needs, and provide most relevant information to help customers make confident shopping decisions. We are seeking an Applied Scientist to make step function improvements in creating a delightful shopping experience. We are open to hiring candidates to work out of one of the following locations: Seattle, WA, USA