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Commits on Aug 28, 2026
Fix: Initialize LCAO LDOS DMR independently (#7874)
AsTonyshment
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1b3baf0
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Refactor: Remove obsolete `cg_in_lcao` code (#7870)
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Fix: Correct LCAO real-space wavefunctions and partial-charge handling (#7868)
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AsTonyshment
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74dcbdf
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Commits on Aug 27, 2026
Refactor DFT+U, step 4 (#7861)
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mohanchen
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abacus_fixer
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Unify RT-TDDFT EXX with the general LCAO H(R) path (#7864)
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ESROAMER
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Refactor hsolver: drop dead global includes and GlobalV::DSIZE (#7865)
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Critsium-xy
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claude
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39564a1
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Commits on Aug 26, 2026
Refactor DFT+U: rename and de-static Plus_U members, step 3 (#7859)
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mohanchen
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abacus_fixer
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Refactor output formats of deltaspin method (#7857)
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Commits on Aug 25, 2026
Refactor DFT+U step 2 (#7858)
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mohanchen
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abacus_fixer
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0484e5b
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Add a python script to test the code quality of ABACUS codes (#7843)
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mohanchen
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abacus_fixer
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Commits on Aug 24, 2026
Refactor DFT+U codes (#7852)
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mohanchen
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abacus_fixer
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Commits on Aug 23, 2026
fix(gpu): avoid host-side FFT crash in LDOS output and wfc-read charge density (#7847)
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Fix: Correct PW KPAR/BNDPAR occupations and distributed output (#7845)
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AsTonyshment
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75145da
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CMake: Decouple ELPA dependency from LCAO (#7842)
Growl1234
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3af0946
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Commits on Aug 21, 2026
Fix: calculate net force after symmetrization (#7846)
maki49
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0dca9dd
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vdW-D4: Switch to smooth cutoff (#7810)
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Growl1234
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Feature: Support nspin=4 PW partial-charge and wavefunction `.cube` output (Useful Information to know how to use out_pchg, out_wfc_norm, and out_wfc_re_im functions) (#7841)
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mohanchen
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74d75b7
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Remove GlobalC::exx_info entirely, refactor ESolver, add esolver_refactor.cpp, remove most PARAM in ESolver (#7805)
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mohanchen
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abacus_fixer
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fac9330
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Commits on Aug 20, 2026
Fix: refresh v_eff again after updating XC type (#7840)
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maki49
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815c370
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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…
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chengleizheng
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chengleizheng
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cd270a7
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fix(gpu): guard qq synchronization without projectors (#7816)
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Gengze Lin
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fix(input): constrain diag_subspace availability (#7835)
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Stardust0831
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0a91426
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CMake: build serial unit tests without MPI (#7836)
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Stardust0831
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258314a
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Fix an out-of-bound read in XC module at dft_functional=HF (#7837)
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maki49
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978e3b6
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Commits on Aug 18, 2026
Fix: add 'template' keyword for dependent eval_wfc_bloch call (#7827)
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dyzheng
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dyzheng
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c0d1dcd
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Fix(dftu): write dm_onsite.txt format matching read_occup_m parser (#7828)
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dyzheng
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dyzheng
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fde7e06
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fix: `get_pchg_lcao.cpp` with c^* c^T (#7821)
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Fisherd99
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4cf51c6
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fix(input): align canonical availability grammar (#7823)
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Stardust0831
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ce34384
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Commits on Aug 14, 2026
Refactor: structured INPUT parameter availability (Phase 1) (#7783)
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Stardust0831
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dd1a240
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Feature: Enable correct Laplacian-dependent meta-GGA calculations (#7820)
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AsTonyshment
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65a5039
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Fix(pw): correct atom index in non-collinear non-local stress on GPU (#7818)
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dyzheng
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acf177d
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Commits on Aug 13, 2026
fix(xc): implement proper Laplacian calculation for SCAN-L functional (Useful Information for discussing implementation of SCAN-L functional) (#7457)
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feat: add BSE module (#7718)
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Fisherd99
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1e4c1c6
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feat: add distributed MdCell domain decomposition (#7768)
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648aff5
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Refactor: normalize and shorten source filenames for consistency (#7797)
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mohanchen
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abacus_fixer
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3b22343
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