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BugsBugs that only solvable with sufficient knowledge of DFTBugs that only solvable with sufficient knowledge of DFTGeometryRelaxationIssues related to geometry relaxationIssues related to geometry relaxationInput&OutputSuitable for coders without knowing too many DFT detailsSuitable for coders without knowing too many DFT detailsLong-Time Support (LTS)Issues related to LTS versionIssues related to LTS version
Description
Describe the bug
When dealing with cell-relax job, we can get Largest gradient information from running_cell-relax.log file
And then one can use abacustest to extract this information
However, for relax job, this Largest gradient information was lost.
And one can't extract Largest gradient information in running_relax.log file.
Expected behavior
Largest gradient information should be print-out in running_relax.log file as usual.
To Reproduce
Use ABACUS 3.10.1 to finish a relax calculation, and execute grep -i Largest OUT*/running_relax.log, there should be largest gradient information, which have the same value as grep -i LARGEST [stdout file]
Environment
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Additional Context
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BugsBugs that only solvable with sufficient knowledge of DFTBugs that only solvable with sufficient knowledge of DFTGeometryRelaxationIssues related to geometry relaxationIssues related to geometry relaxationInput&OutputSuitable for coders without knowing too many DFT detailsSuitable for coders without knowing too many DFT detailsLong-Time Support (LTS)Issues related to LTS versionIssues related to LTS version


