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Change 'istate.info' to 'eig.txt', add explanations for the parameter "out_band" (open files eigs1.txt and eigs2.txt). In the 'after_all_runners" subroutine in SDFT, use after_all_runners from ESolver_KS#6257

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sunliang98 merged 22 commits intodeepmodeling:developfrom
mohanchen:develop
Jun 2, 2025

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Commits on Jun 2, 2025