-
Catching the Imposter: Self-Supervised Learning of Physical Coherence with Cross-Entity Feature Permutations
Authors:
Aleksei Rozanov,
Arvind Renganathan,
Vipin Kumar
Abstract:
Scientific data often describe entities whose features are jointly governed by the laws of physics, yet existing self-supervised learning (SSL) objectives largely ignore this physical coherence. We introduce imposter, a discriminative pretext task that replaces subsets of an entity's features with real observations donated by another entity and trains the encoder to identify the swapped features.…
▽ More
Scientific data often describe entities whose features are jointly governed by the laws of physics, yet existing self-supervised learning (SSL) objectives largely ignore this physical coherence. We introduce imposter, a discriminative pretext task that replaces subsets of an entity's features with real observations donated by another entity and trains the encoder to identify the swapped features. Because every donated value is individually plausible, the task can only be solved by learning cross-feature physical dependencies. We evaluate the proposed objectives on global ERA5-Land reanalysis data using 21 environmental variables and assess the learned representations on seven downstream tasks spanning climate classification, carbon flux estimation, and streamflow prediction. Our study includes, to our knowledge, the first systematic comparison of self-supervised objectives for land-surface modeling under a shared architecture and pre-training budget. We find that the most effective pretext task depends on the downstream task family rather than any single objective's superiority, and that imposter provides complementary information when combined with existing SSL objectives. These results suggest that physical coherence is a valuable new source of self-supervision for scientific foundation models.
△ Less
Submitted 14 August, 2026;
originally announced August 2026.
-
Task Aware Modulation Using Representation Learning for Upsaling of Terrestrial Carbon Fluxes
Authors:
Aleksei Rozanov,
Arvind Renganathan,
Vipin Kumar
Abstract:
Accurately upscaling terrestrial carbon fluxes is central to estimating the global carbon budget, yet remains challenging due to the sparse and regionally biased distribution of ground measurements. Existing data-driven upscaling products often fail to generalize beyond observed domains, leading to systematic regional biases and high predictive uncertainty. We introduce Task-Aware Modulation with…
▽ More
Accurately upscaling terrestrial carbon fluxes is central to estimating the global carbon budget, yet remains challenging due to the sparse and regionally biased distribution of ground measurements. Existing data-driven upscaling products often fail to generalize beyond observed domains, leading to systematic regional biases and high predictive uncertainty. We introduce Task-Aware Modulation with Representation Learning (TAM-RL), a framework that couples spatio-temporal representation learning with knowledge-guided encoder-decoder architecture and loss function derived from the carbon balance equation. Across 150+ flux tower sites representing diverse biomes and climate regimes, TAM-RL improves predictive performance relative to existing state-of-the-art datasets, reducing RMSE by 8-9.6% and increasing explained variance (R2) from 19.4% to 43.8%, depending on the target flux. These results demonstrate that integrating physically grounded constraints with adaptive representation learning can substantially enhance the robustness and transferability of global carbon flux estimates.
△ Less
Submitted 11 March, 2026; v1 submitted 10 March, 2026;
originally announced March 2026.
-
CarbonBench: A Global Benchmark for Upscaling of Carbon Fluxes Using Zero-Shot Learning
Authors:
Aleksei Rozanov,
Arvind Renganathan,
Yimeng Zhang,
Vipin Kumar
Abstract:
Accurately quantifying terrestrial carbon exchange is essential for climate policy and carbon accounting, yet models must generalize to ecosystems underrepresented in sparse eddy covariance observations. Despite this challenge being a natural instance of zero-shot spatial transfer learning for time series regression, no standardized benchmark exists to rigorously evaluate model performance across…
▽ More
Accurately quantifying terrestrial carbon exchange is essential for climate policy and carbon accounting, yet models must generalize to ecosystems underrepresented in sparse eddy covariance observations. Despite this challenge being a natural instance of zero-shot spatial transfer learning for time series regression, no standardized benchmark exists to rigorously evaluate model performance across geographically distinct locations with different climate regimes and vegetation types.
We introduce CarbonBench, the first benchmark for zero-shot spatial transfer in carbon flux upscaling. CarbonBench comprises over 1.3 million daily observations from 567 flux tower sites globally (2000-2024). It provides: (1) stratified evaluation protocols that explicitly test generalization across unseen vegetation types and climate regimes, separating spatial transfer from temporal autocorrelation; (2) a harmonized set of remote sensing and meteorological features to enable flexible architecture design; and (3) baselines ranging from tree-based methods to domain-generalization architectures. By bridging machine learning methodologies and Earth system science, CarbonBench aims to enable systematic comparison of transfer learning methods, serves as a testbed for regression under distribution shift, and contributes to the next-generation climate modeling efforts.
△ Less
Submitted 13 August, 2026; v1 submitted 10 March, 2026;
originally announced March 2026.
-
Knowledge-Guided Machine Learning Models to Upscale Evapotranspiration in the U.S. Midwest
Authors:
Aleksei Rozanov,
Samikshya Subedi,
Vasudha Sharma,
Bryan C. Runck
Abstract:
Evapotranspiration (ET) plays a critical role in the land-atmosphere interactions, yet its accurate quantification across various spatiotemporal scales remains a challenge. In situ measurement approaches, like eddy covariance (EC) or weather station-based ET estimation, allow for measuring ET at a single location. Agricultural uses of ET require estimates for each field over broad areas, making it…
▽ More
Evapotranspiration (ET) plays a critical role in the land-atmosphere interactions, yet its accurate quantification across various spatiotemporal scales remains a challenge. In situ measurement approaches, like eddy covariance (EC) or weather station-based ET estimation, allow for measuring ET at a single location. Agricultural uses of ET require estimates for each field over broad areas, making it infeasible to deploy sensing systems at each location. This study integrates tree-based and knowledge-guided machine learning (ML) techniques with multispectral remote sensing data, griddled meteorology and EC data to upscale ET across the Midwest United States. We compare four tree-based models - Random Forest, CatBoost, XGBoost, LightGBM - and a simple feed-forward artificial neural network in combination with features engineered using knowledge-guided ML principles. Models were trained and tested on EC towers located in the Midwest of the United States using k-fold cross validation with k=5 and site-year, biome stratified train-test split to avoid data leakage. Results show that LightGBM with knowledge-guided features outperformed other methods with an R2=0.86, MSE=14.99 W m^-2 and MAE = 8.82 W m^-2 according to grouped k-fold validation (k=5). Feature importance analysis shows that knowledge-guided features were most important for predicting evapotranspiration. Using the best performing model, we provide a data product at 500 m spatial and one-day temporal resolution for gridded ET for the period of 2019-2024. Intercomparison between the new gridded product and state-level weather station-based ET estimates show best-in-class correspondence.
△ Less
Submitted 13 October, 2025;
originally announced October 2025.
-
CayleyPy RL: Pathfinding and Reinforcement Learning on Cayley Graphs
Authors:
A. Chervov,
M. Obozov,
A. Soibelman,
S. Lytkin,
I. Kiselev,
S. Fironov,
A. Lukyanenko,
A. Dolgorukova,
A. Ogurtsov,
F. Petrov,
S. Krymskii,
M. Evseev,
L. Grunvald,
D. Gorodkov,
G. Antiufeev,
G. Verbii,
V. Zamkovoy,
L. Cheldieva,
I. Koltsov,
A. Sychev,
A. Eliseev,
S. Nikolenko,
N. Narynbaev,
R. Turtayev,
N. Rokotyan
, et al. (9 additional authors not shown)
Abstract:
This paper is the second in a series of studies on developing efficient artificial intelligence-based approaches to pathfinding on extremely large graphs (e.g. $10^{70}$ nodes) with a focus on Cayley graphs and mathematical applications. The open-source CayleyPy project is a central component of our research. The present paper proposes a novel combination of a reinforcement learning approach with…
▽ More
This paper is the second in a series of studies on developing efficient artificial intelligence-based approaches to pathfinding on extremely large graphs (e.g. $10^{70}$ nodes) with a focus on Cayley graphs and mathematical applications. The open-source CayleyPy project is a central component of our research. The present paper proposes a novel combination of a reinforcement learning approach with a more direct diffusion distance approach from the first paper. Our analysis includes benchmarking various choices for the key building blocks of the approach: architectures of the neural network, generators for the random walks and beam search pathfinding. We compared these methods against the classical computer algebra system GAP, demonstrating that they "overcome the GAP" for the considered examples. As a particular mathematical application we examine the Cayley graph of the symmetric group with cyclic shift and transposition generators. We provide strong support for the OEIS-A186783 conjecture that the diameter is equal to n(n-1)/2 by machine learning and mathematical methods. We identify the conjectured longest element and generate its decomposition of the desired length. We prove a diameter lower bound of n(n-1)/2-n/2 and an upper bound of n(n-1)/2+ 3n by presenting the algorithm with given complexity. We also present several conjectures motivated by numerical experiments, including observations on the central limit phenomenon (with growth approximated by a Gumbel distribution), the uniform distribution for the spectrum of the graph, and a numerical study of sorting networks. To stimulate crowdsourcing activity, we create challenges on the Kaggle platform and invite contributions to improve and benchmark approaches on Cayley graph pathfinding and other tasks.
△ Less
Submitted 15 May, 2026; v1 submitted 25 February, 2025;
originally announced February 2025.