Papers & Surveys

Must-read benchmark papers and technical surveys (no news or industry reports)

The Scott-Vogelius Element is Inf-Sup Stable on Freudenthal Meshes for k ≥ 4

Structural
This paper rigorously establishes inf-sup stability of the Scott-Vogelius finite element on three-dimensional Freudenthal meshes for polynomial degree k ≥ 4, completing the theoretical framework for this classical divergence-free mixed element used in Stokes flow computations.
See LICENSE file finite element methodsStokes probleminf-sup stability

Predictive Uncertainty for Neural CAE Surrogates

ScientificML
Investigates how uncertainty quantification approaches perform when adapted to geometry-conditioned neural surrogates for CAE, comparing closed-form and sampling-based methods across varying geometries and engineering quantities of interest.
See LICENSE file neural surrogatesuncertainty quantificationCAE simulation

MARC-TS: Learning Continuous Reaction Paths for Transition-State Prediction

Quantum/Chemical
MARC-TS introduces a two-stage framework that learns endpoint-conditioned continuous reaction paths, queries at arbitrary resolution, and refines transition-state candidates via local path context, with T1x-IRC-8K dataset of 8,209 reactions and 1.09M path-resolved geometries.
See LICENSE file reaction pathtransition statechemical reaction

Sparse-Observation Atmospheric Thermal Forecasting with Physics-Informed Neural Networks for Climate-Aware Digital Twins

CFD/Fluid
This study evaluates physics-informed neural networks for atmospheric potential-temperature forecasting, constrained by pressure-coordinate thermodynamic advection-source equations to address short-horizon predictions under sparse thermal observation conditions.
See LICENSE file Physics-Informed Neural NetworksAtmospheric Temperature ForecastingDigital Twins

Doubly exponential convergence of the cyclic steepest descent method for strictly convex quadratics in arbitrary dimensions

ScientificML
This paper studies the convergence properties of the cyclic steepest descent (CSD) method for minimizing strictly convex quadratic functions in arbitrary dimensions, proving doubly exponential convergence rates and extending prior theoretical results limited to two-dimensional cases.
See LICENSE file numerical optimizationconvex optimizationcyclic steepest descent

Physics-Informed Self-Supervised Learning for Joint Wire Calibration and Interaction Position Reconstruction in Multi-Wire Parallel Plate Avalanche Counters

High-Energy Physics
A physics-informed self-supervised learning framework that jointly performs wire calibration and interaction position reconstruction in multi-wire parallel plate avalanche counters, enhancing adaptability to changing operating conditions and detector aging.
See LICENSE file particle detectorwire calibrationposition reconstruction

Adaptive Physics Transformer with Fused Global-Local Attention for Subsurface Energy Systems

Original Research Paper
ICML 2026 paper proposing APT, a geometry-/mesh-/physics-agnostic neural operator that fuses graph-based local feature extraction with global attention for long-range physical effects; achieves 4× saturation error reduction on 2D faulted CO2 storage vs prior SOTA, 19,873× speedup over GEOS and 6,800× over ECLIPSE.
arXiv preprint (copyright held by authors) Neural OperatorSubsurface EnergyCO2 Storage

ATOM: A Pretrained Neural Operator for Multitask Molecular Dynamics

Original Research Paper
ICLR 2026 paper proposing ATOM, a quasi-equivariant pretrained transformer neural operator that requires no explicit molecular graph and uses temporal attention for parallel decoding of multiple future states; curates TG80 (80 compounds, 2.5M fs trajectories) and demonstrates zero-shot generalization on MD17/RMD17/MD22.
arXiv preprint (copyright held by authors) Neural OperatorMolecular DynamicsTransformer
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