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Pull requests: deepmodeling/abacus-develop

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Pull requests list

Add "#TOTAL ENERGY#" after each ion step Bugs Bugs that only solvable with sufficient knowledge of DFT Refactor Refactor ABACUS codes
#6342 opened Jun 28, 2025 by mohanchen Loading…
Uploading hybrid gague tddft Features Needed The features are indeed needed, and developers should have sophisticated knowledge Refactor Refactor ABACUS codes
#6341 opened Jun 27, 2025 by ESROAMER Loading…
Feature: Implement stress_ewa_op for sincos parallel GPU & DCU & HPC GPU and DCU and HPC related any issues Refactor Refactor ABACUS codes
#6302 opened Jun 17, 2025 by jieli-matrix Loading…
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