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Update DFPT (pw) codes (#7894) Doxygen Documentation Deployment #144: Commit c2fa3ac pushed by Critsium-xy
1s develop
develop
1s
Fix: revert #7664 $m_y$ convention (#7832) Doxygen Documentation Deployment #143: Commit f29968d pushed by Critsium-xy
9s develop
develop
9s
Refactor DFT+U, step 5 (#7867) Doxygen Documentation Deployment #142: Commit 370e024 pushed by Critsium-xy
1s develop
develop
1s
Refactor DFT+U: rename and de-static Plus_U members, step 3 (#7859) Doxygen Documentation Deployment #141: Commit 0aa8d8b pushed by Critsium-xy
1s develop
develop
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Add runtime validation for ELPA complex BLOCK2 kernels (#7790) Doxygen Documentation Deployment #140: Commit d923b08 pushed by Critsium-xy
1s develop
develop
1s
fix a bug when init_wfc=nao in pw basis for nspin=4 (#7747) Doxygen Documentation Deployment #139: Commit 48a3954 pushed by Critsium-xy
1s develop
develop
1s
Fix: use real radial grids in RT projector interpolation (Useful Info… Doxygen Documentation Deployment #138: Commit c5e066e pushed by Critsium-xy
1s develop
develop
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Fix Dockerfiles (#7703) Doxygen Documentation Deployment #137: Commit 3e64d44 pushed by Critsium-xy
1s develop
develop
1s
Libxc: 7.0.0 -> 7.1.2 (toolchain); fix external parameter handling (#… Doxygen Documentation Deployment #136: Commit 83c89c4 pushed by Critsium-xy
1s develop
develop
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Fix CUDA-aware MPI send synchronization in PGemm (#7688) Doxygen Documentation Deployment #135: Commit 18a0da0 pushed by Critsium-xy
10s develop
develop
10s
Fix: check restart file reading and fix MPI datatype mismatch for boo… Doxygen Documentation Deployment #134: Commit 079fd0c pushed by Critsium-xy
11s develop
develop
11s
Fix: correct Pauli-to-spinor Hamiltonian conversion for nspin=4 (#7664) Doxygen Documentation Deployment #133: Commit 1457e26 pushed by Critsium-xy
10s develop
develop
10s
Refactor: move EXX file-list broadcast out of source_cell (#7635) (#7… Doxygen Documentation Deployment #132: Commit 83e5099 pushed by Critsium-xy
8s develop
develop
8s
Fix: Restore incremental builds with pkg-config ELPA (#7662) Doxygen Documentation Deployment #131: Commit 1dd484d pushed by Critsium-xy
10s develop
develop
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add TB2J_interface (#7659) Doxygen Documentation Deployment #130: Commit 5b4ed07 pushed by Critsium-xy
1s develop
develop
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Doc: Fix a LaTeX rendering issue of out_current in the doc (#7641) Doxygen Documentation Deployment #129: Commit 6040a5e pushed by Critsium-xy
9s develop
develop
9s
Update source_cell module and agent governance (#7625) Doxygen Documentation Deployment #128: Commit 31c899d pushed by Critsium-xy
7s develop
develop
7s
Feature: velocity matrix correction for meta-gga xc functionals (#7391) Doxygen Documentation Deployment #127: Commit a02d7c7 pushed by Critsium-xy
6s develop
develop
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Modify AI agent (#7586) Doxygen Documentation Deployment #126: Commit 69e2b1e pushed by Critsium-xy
9s develop
develop
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Test: Refactor DeePKS Unit Tests (#7577) Doxygen Documentation Deployment #125: Commit 548bf8f pushed by Critsium-xy
2s develop
develop
2s
Refactor&Test: Share RT-TDDFT velocity gauge projector snap integrati… Doxygen Documentation Deployment #124: Commit 51e2074 pushed by Critsium-xy
2s develop
develop
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refactor(pw): optimize bspline structure factor grid (#7508) Doxygen Documentation Deployment #123: Commit 84ca04b pushed by Critsium-xy
1s develop
develop
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Reset BFGS history after cell changes (#7507) Doxygen Documentation Deployment #122: Commit 4b1fc7d pushed by Critsium-xy
1s develop
develop
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Refactor: remove some unhealthy include dependencies (#7512) Doxygen Documentation Deployment #121: Commit f7b3111 pushed by Critsium-xy
Skipped develop
develop
Skipped
feat(md): add CSVR thermostat for NVT molecular dynamics (#7461) Doxygen Documentation Deployment #120: Commit 777f50c pushed by Critsium-xy
7s develop
develop
7s