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Refactor output_chemical_composition format #231

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Merged
srmnitc merged 1 commit into from
Mar 10, 2026
Merged

Refactor output_chemical_composition format #231

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8 changes: 4 additions & 4 deletions docs/source/inputfile.md
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Original file line number Diff line number Diff line change
Expand Up @@ -982,8 +982,8 @@ This block contains keywords that are used only for the mode `composition_scalin
```
composition_scaling:
output_chemical_composition:
- Cu: 513
- Zr: 511
Cu: 513
Zr: 511
```

---
Expand All @@ -995,8 +995,8 @@ _type_: list \
_example_:
```
output_chemical_composition:
- Cu: 513
- Zr: 511
Cu: 513
Zr: 511
```

The output chemical composition in number of atoms. The total number of atoms should be equal to the input provided.
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