总能量应该是potential
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@@ -51,7 +51,7 @@ The following is the optimized crystal structure information:
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### Optimized {output_format.upper()} Content:
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```{output_format}
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{optimized_content[:800]}
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{optimized_content[:300]}
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```
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Due to length limitations, the complete {output_format.upper()} file has been uploaded to the following link:
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