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README.md
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---
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license: cc-by-4.0
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task_categories:
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- reinforcement-learning
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tags:
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- stem-microscopy
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- electron-microscopy
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- materials-science
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- gymnasium
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- benchmark
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- dose-efficiency
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- autonomous-microscopy
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pretty_name: STEMGym Benchmark
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size_categories:
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- 1K<n<10K
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---
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# STEMGym: A Gymnasium Environment for Benchmarking Dose-Efficient Autonomous Scanning Transmission Electron Microscopy
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A Gymnasium-based benchmark environment for evaluating autonomous dose-efficient scanning transmission electron microscopy (STEM) agents.
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## Dataset Description
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STEMGym provides simulated STEM specimens as HDF5 world files. Each world contains:
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- **Overview image**: Low-magnification survey of the full specimen
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- **Tile grid**: High-resolution STEM-HAADF images (128x128 px tiles, 4px overlap, stride=124) arranged in an 8x8 grid
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- **Ground truth annotations**: Atom positions, defect types, and phase maps for scoring
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- **Metadata**: Pixel size, accelerating voltage, detector geometry, material parameters
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### Materials
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| Material | Zone Axis | FOV | Defect Types | Task |
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|----------|-----------|-----|-------------|------|
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| SrTiO3 | [001] | ~100 nm | O vacancies clustered along grain boundary | Defect Census |
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| BaTiO3 | [001] | ~100 nm | Cubic/tetragonal phase boundaries + O vacancies | Phase Mapping + Defect Census |
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| SiGe | [110] | ~50 nm | Ge substitutions concentrated in one quadrant | Targeted Characterization |
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| GaN | [11-20] | ~80 nm | InGaN quantum-well substitutions | Defect Census |
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| Pt nanoparticles | — | ~60 nm | Pt nanoparticles on amorphous carbon | Particle Census |
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### Difficulty Levels
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Each material is provided at three difficulty levels:
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| Level | Vacancy Rate | Phonon Configs | Dose (e-/A^2) |
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|-------|-------------|----------------|---------------|
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| Easy | 5% | 4 | 1e4 |
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| Medium | 3% | 8 | 5e3 |
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| Hard | 1% | 16 | 1e3 |
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## Files
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### Simulated Worlds (`worlds/`)
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| File | Material | Difficulty | Size |
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|------|----------|-----------|------|
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| `test_world.h5` | Synthetic (Gaussian blobs) | — | 9.7 MB |
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| `replay_world.h5` | Synthetic (replay validation) | — | 2.5 MB |
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| `srtio3_clustered_easy.h5` | SrTiO3 | Easy | 884 MB |
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| `srtio3_clustered_medium.h5` | SrTiO3 | Medium | 884 MB |
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| `srtio3_clustered_hard.h5` | SrTiO3 | Hard | 885 MB |
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| `batio3_interface_easy.h5` | BaTiO3 | Easy | 911 MB |
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| `batio3_interface_medium.h5` | BaTiO3 | Medium | 911 MB |
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| `batio3_interface_hard.h5` | BaTiO3 | Hard | 911 MB |
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| `sige_gradient_clustered_easy.h5` | SiGe | Easy | 150 MB |
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| `sige_gradient_clustered_medium.h5` | SiGe | Medium | 148 MB |
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| `sige_gradient_clustered_hard.h5` | SiGe | Hard | 147 MB |
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| `gan_easy.h5` | GaN | Easy | 451 MB |
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| `gan_medium.h5` | GaN | Medium | 449 MB |
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| `gan_hard.h5` | GaN | Hard | 448 MB |
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| `pt_nanoparticles_easy.h5` | Pt | Easy | 129 MB |
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| `pt_nanoparticles_medium.h5` | Pt | Medium | 129 MB |
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| `pt_nanoparticles_hard.h5` | Pt | Hard | 129 MB |
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### Model Checkpoints (`checkpoints/`)
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| File | Model | Description | Size |
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|------|-------|-------------|------|
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| `atom_finder.pt` | AtomFinderUNet | Atomic column detection ensemble (3 members) | 88 MB |
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| `defect_classifier.pt` | DefectClassifierCNN | Defect type classification | 1.4 MB |
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| `phase_identifier.pt` | PhaseIdentifierResNet | Material phase identification | 7.4 MB |
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| `dqn_agent.zip` | DQN (SB3) | RL navigation baseline | 0.8 MB |
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| `ppo_agent.zip` | PPO (SB3) | RL navigation baseline | 1.0 MB |
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| `sac_agent.zip` | SAC (SB3) | RL navigation baseline | 8.4 MB |
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### Transfer Checkpoints (`checkpoints/transfer/`)
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Material-specific analyst models trained on individual materials for transfer experiments:
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| Directory | Contents |
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|-----------|----------|
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| `transfer/srtio3/` | atom_finder.pt, defect_classifier.pt, phase_identifier.pt, training_metadata.json |
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| `transfer/batio3/` | atom_finder.pt, defect_classifier.pt, phase_identifier.pt, training_metadata.json |
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| `transfer/sige/` | atom_finder.pt, defect_classifier.pt, phase_identifier.pt, training_metadata.json |
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| `transfer/gan/` | atom_finder.pt, defect_classifier.pt, phase_identifier.pt, training_metadata.json |
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## HDF5 World Format
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Each world file follows this layout:
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```
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/metadata/
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pixel_size_nm # Physical pixel size
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tile_size_px # Tile dimensions (128)
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grid_shape # Grid dimensions (rows, cols)
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fov_nm # Field of view in nm
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scenario # Material/scenario name
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difficulty # easy / medium / hard
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/overview # (H, W) low-res overview image
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/tiles/{row}_{col} # (128, 128) float32 normalized HAADF tiles
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/ground_truth/
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atom_positions # (N, 2) in nm
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atom_types # (N,) int [0=pristine, 1=vacancy, 2=substitution]
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defect_mask # (N,) bool
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defect_types # (N,) str ["pristine"/"vacancy"/"substitution"]
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phase_map # (H, W) int32, optional
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/valid_region # (H, W) bool
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```
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## Usage
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```bash
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pip install -e .
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python stem_gym/scripts/download_data.py
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stemgym run --agent raster_equipped --task defect_census --world srtio3_clustered_easy --seeds 3
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```
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## License
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This dataset is released under the [CC-BY-4.0](https://creativecommons.org/licenses/by/4.0/) license.
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## Citation
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```bibtex
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@inproceedings{anonymous2026stemgym,
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title={STEMGym: A Gymnasium Environment for Benchmarking Dose-Efficient Autonomous Scanning Transmission Electron Microscopy},
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author={Anonymous},
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year={2026}
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}
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```
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