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Create singleFrame-abacus2nep-exyz.sh #715

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merged 1 commit into from
Aug 27, 2024

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tang070205
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Based on the shell script for extracting the training set from vasp2xyz, changes were made to get the script for extracting the training set from abacus2xyz from ABACUS

@brucefan1983 brucefan1983 merged commit 6a1b814 into brucefan1983:master Aug 27, 2024
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