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Commits · deepmodeling/abacus-develop · GitHub

Commits

Commits on Aug 29, 2026

Refactor DFT+U, step 5 (#7867)

mohanchen
and
abacus_fixer
authored
370e024
Split vnl_pw.cpp into several smaller files (#7869)

mohanchen
and
abacus_fixer
authored
196d199

Commits on Aug 28, 2026

Fix: Initialize LCAO LDOS DMR independently (#7874)
AsTonyshment
authored
1b3baf0
Refactor: Remove obsolete `cg_in_lcao` code (#7870)
AsTonyshment
authored
e461ffd
Fix: Correct LCAO real-space wavefunctions and partial-charge handling (#7868)
AsTonyshment
authored
74dcbdf

Commits on Aug 27, 2026

Refactor DFT+U, step 4 (#7861)

mohanchen
and
abacus_fixer
authored
5fb17a6
test: add validated NAO cases to CUDA CI (#7856)
GenZeal-Lin
authored
8d8884b
Unify RT-TDDFT EXX with the general LCAO H(R) path (#7864)
ESROAMER
authored
e329296
Refactor hsolver: drop dead global includes and GlobalV::DSIZE (#7865)

Critsium-xy
and
claude
authored
39564a1

Commits on Aug 26, 2026

Refactor DFT+U: rename and de-static Plus_U members, step 3 (#7859)

mohanchen
and
abacus_fixer
authored
0aa8d8b
update CASES_GPU (#7862)

chengleizheng
and
chengleizheng
authored
8925fdc
Refactor output formats of deltaspin method (#7857)

authored
07dfb32

Commits on Aug 25, 2026

Refactor DFT+U step 2 (#7858)

mohanchen
and
abacus_fixer
authored
0484e5b
Add a python script to test the code quality of ABACUS codes (#7843)

mohanchen
and
abacus_fixer
authored
c9bae03

Commits on Aug 24, 2026

Refactor DFT+U codes (#7852)

mohanchen
and
abacus_fixer
authored
12ecc79
Docker: Move PEXSI installation from Dockerfile.intel to Dockerfile.gnu (#7853)
Growl1234
authored
f7209c8

Commits on Aug 23, 2026

Commits on Aug 21, 2026

Commits on Aug 20, 2026

Fix: refresh v_eff again after updating XC type (#7840)
maki49
authored
815c370

Commits on Aug 19, 2026

Fix 007_PW_UPF201_USPP_Fe in 01_PW: G=0 indexing in nspin=2 mixing inner products (Useful Information to know why previous versions yield small energy differences when nspin=2 with different number…

chengleizheng
and
chengleizheng
authored
cd270a7
fix(gpu): guard qq synchronization without projectors (#7816)

GenZeal-Lin
and
Gengze Lin
authored
b3691d0
fix(input): constrain diag_subspace availability (#7835)
Stardust0831
authored
0a91426
CMake: build serial unit tests without MPI (#7836)
Stardust0831
authored
258314a
Fix an out-of-bound read in XC module at dft_functional=HF (#7837)
maki49
authored
978e3b6

Commits on Aug 18, 2026

Fix: add 'template' keyword for dependent eval_wfc_bloch call (#7827)

dyzheng
and
dyzheng
authored
c0d1dcd
Fix(dftu): write dm_onsite.txt format matching read_occup_m parser (#7828)

dyzheng
and
dyzheng
authored
fde7e06
fix: `get_pchg_lcao.cpp` with c^* c^T (#7821)
Fisherd99
authored
4cf51c6
Update installation documentation (#7811)
Growl1234
authored
899ad88
fix(input): align canonical availability grammar (#7823)
Stardust0831
authored
ce34384

Commits on Aug 14, 2026

Refactor: structured INPUT parameter availability (Phase 1) (#7783)
Stardust0831
authored
dd1a240

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