Comments (1)
The example is from #4171
from abacus-develop.
Related Issues (20)
- RT-TDDFT restart error HOT 5
- Refactor: remove globalV in hsolver_pw
- Bug: Incorrect calculation of partial charge for multi-k-points under both PW and LCAO when symmetry is turned on HOT 4
- Refactoring: Remove the non-functional 'pdiagh' Pointer in hsolver
- Bug: Eigenvalues are too large! in mGGA SCF HOT 1
- Inconsistent interface of BLAS gemm HOT 3
- No Fail in CI when unexpected warning_quit is excuted.
- Compilation error with v3.7.0 HOT 3
- DCU compile error HOT 1
- Request: plenty of functions are not recorded or recorded correctly with timer
- Compile warnings could be eliminated HOT 2
- Request: Need to speed up the hamilt-pw force_scc module.
- Abosolute path in STRU is conficted with the change of default setting of `pseudo_dir` and `orbital_dir` in version 3.7.1 set to `./`
- Inquiry: Use of Macros vs. Internal Variables for Controlling Code Versions for GPU Builds HOT 3
- Request: Virtual Crystal Approximation for disorder soild simulation HOT 1
- Different atom mag results with primitive and supercell HOT 1
- phonopy interface generated supercells lack mag info HOT 2
- Is the formula for Trigonometric type electric field right in the doc? HOT 4
- electronic step not convergent when using ELPA-2024.05 HOT 1
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from abacus-develop.