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Wrong ground state energy when using nvhpc/26.5

Status: Open.

#1274 In SALMON-TDDFT/SALMON2;

· william-dawson opened on Jul 21, 2026

UPF reader: spin-orbit channels are assigned by read order, not by jjj (j = l+1/2 and l-1/2 are swapped)

Status: Open.

#1273 In SALMON-TDDFT/SALMON2;

· MZKC opened on Jul 14, 2026

nonorth r-space: hpsi_nonorth_rspace allocates orbital-block work arrays on every call

Status: Open.

#1269 In SALMON-TDDFT/SALMON2;

· MZKC opened on Jun 24, 2026

CG: cg%pre_gk duplicates gk when preconditioning is off (optional memory saving)

Status: Open.

#1264 In SALMON-TDDFT/SALMON2;

· MZKC opened on Jun 18, 2026

DFT+U: pseudo_plusU real-space-divided branch does not apply V_eff / proj_pairs

Status: Open.

#1263 In SALMON-TDDFT/SALMON2;

· MZKC opened on Jun 18, 2026

DFT+U: calc_phipsi_rdivided uses an uninitialized index (loop var iproj vs ilma)

Status: Open.

#1262 In SALMON-TDDFT/SALMON2;

· MZKC opened on Jun 18, 2026

DFT+U: real-time current omits the +U (Hubbard) contribution

Status: Open.

#1261 In SALMON-TDDFT/SALMON2;

· MZKC opened on Jun 18, 2026

TBmBJ initialization is ill-conditioned for low/zero-density regions of a localized initial guess

Status: Open.

#1253 In SALMON-TDDFT/SALMON2;

· MZKC opened on Jun 18, 2026

RT energy balance: propagator-dependent accuracy of ∫E·J vs total-energy change

Status: Open.

#1251 In SALMON-TDDFT/SALMON2;

· MZKC opened on Jun 18, 2026

SALMON with GPU (invalid device symbol)

Status: Open.

#1201 In SALMON-TDDFT/SALMON2;

· DaveiV opened on Jul 17, 2024

add topics

Status: Open.

#1099 In SALMON-TDDFT/SALMON2;

· Beliavsky opened on Feb 12, 2022

dft_k_expand option does not work on Fugaku

Status: Open.

#956 In SALMON-TDDFT/SALMON2;

· ayamada224 opened on Oct 23, 2020