| .. |
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regtest-admm-1
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-admm-2
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-admm-3
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-admm-4
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-admm-dm
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-admm-gapw
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-admm-libxc
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-admm-qps
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-admm-qps-2
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-admm-type
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-all-electron
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-almo-1
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-almo-2
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-almo-eda
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-almo-md
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-almo-strong
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-almo-trustr
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-as
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-as-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-as-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-as-3
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-as-dft
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-bs
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Adapt tolerance
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2025-06-18 14:26:57 +02:00 |
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regtest-bse
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Adjust tolerance of BSE_H2O_PBE_evGW0_TDHF_screening.inp
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2025-03-09 23:21:51 +01:00 |
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regtest-cdft-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-3
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-3-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-4-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-4-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-4-3
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-5
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-diag
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-cdft-hirshfeld
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-hirshfeld-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-cdft-hirshfeld-3
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-chi-1
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-corr_dipm
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-cusolver
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-dcdft-force
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-dcdft-hfx
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-dcdft-stress
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-dcdr
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Atomic polarization tensors via numerical differentiation
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2025-07-21 19:40:43 +02:00 |
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regtest-debug-1
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-debug-2
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-debug-3
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-debug-4
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-debug-5
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-debug-6
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-debug-7
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-dft-filtermat
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-dft-vdw-corr-1
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-dft-vdw-corr-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-dft-vdw-corr-3
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-dft-vdw-corr-4
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Jvp ghost d4 (#4005)
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2025-03-07 14:36:25 +01:00 |
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regtest-dlaf
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Improve DLA-Future integration
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2025-04-30 19:44:01 +02:00 |
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regtest-dlaf-2
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Improve DLA-Future integration
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2025-04-30 19:44:01 +02:00 |
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regtest-dm-ls-scf-1
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-dm-ls-scf-2
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-dm-ls-scf-3
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-dm-ls-scf-4
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-1
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-2
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-3
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-grad
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-grad-laplace
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-grad-meta
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-grad-numer
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-grad-numer-meta
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-stress
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-stress-laplace
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-stress-meta
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-stress-numer
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-stress-numer-laplace
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-double-hybrid-stress-numer-meta
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-ec
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-ec-force
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-ec-meta
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-ec-stress
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-ecp
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Grpp: Fix floating point exception in grpp_screening.c
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2025-07-21 13:14:37 +02:00 |
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regtest-ecp-2
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Grpp: Fix floating point exception in grpp_screening.c
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2025-07-21 13:14:37 +02:00 |
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regtest-ed
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-eht-guess
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-elpa
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-elpa-2
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-elpa-qr
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-embed
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-epr-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-epr-2
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-fftw
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-fftw-wisdom
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-gapw
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-gapw-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gapw-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gapw-3
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gapw-4
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gapw-ext
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gapw_xc
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-gpw-1
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Remove old TDDFPT code (#4066)
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2025-03-11 17:24:23 +01:00 |
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regtest-gpw-2-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gpw-2-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gpw-2-3
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-gpw-3
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gpw-4
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Workaround Floating-point exception in H2O_wavelet_XZ.inp
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2025-07-20 10:20:55 +02:00 |
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regtest-gpw-5
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gpw-6-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gpw-6-3
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gpw-6-4
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gpw-7
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gpw-8
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gpw-9
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-grid
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-gw
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Interface for greenX library
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2025-03-14 22:58:29 +01:00 |
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regtest-gw-cubic
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Interface for greenX library
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2025-03-14 22:58:29 +01:00 |
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regtest-gw-ic-model
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-gw-kpoints
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Toolchain: Add GreenX
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2025-03-28 22:12:22 +01:00 |
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regtest-gw2x
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-harris
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-hf-3c
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Fix GCP
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2025-05-09 10:35:54 +02:00 |
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regtest-hfx
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Adjust tolerances after Merlin update from RHEL7 to RHEL8
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2025-05-01 15:07:57 +02:00 |
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regtest-hfx-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-hfx-block
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-hfx-bug-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-hfx-periodic
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-hfx-ri
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RI-HFXk| various improvements
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2025-07-21 09:49:12 +02:00 |
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regtest-hfx-ri-2
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RI-HFXk| various improvements
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2025-07-21 09:49:12 +02:00 |
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regtest-hfx-stress
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-hfx-wfn-fitting
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-hirshfeld
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-hole-funct
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-hybrid-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-hybrid-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-hybrid-3
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-hybrid-4
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-iao
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-kg
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-kind
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-kp-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-kp-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-kp-3
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Smearing with fixed magnetic moment for k-points (#4131)
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2025-04-10 15:21:18 +02:00 |
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regtest-kp-hfx-ri
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RI-HFXk| various improvements
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2025-07-21 09:49:12 +02:00 |
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regtest-kp-hfx-ri-2
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Adjust tolerance of QS/regtest-kp-hfx-ri-2/diamond_gpw_stress.inp
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2025-07-21 13:33:45 +02:00 |
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regtest-kp-hfx-ri-admm
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RI-HFXk| various improvements
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2025-07-21 09:49:12 +02:00 |
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regtest-kp-hfx-ri-admm-2
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RI-HFXk| various improvements
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2025-07-21 09:49:12 +02:00 |
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regtest-libxc
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Remove old TDDFPT code (#4066)
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2025-03-11 17:24:23 +01:00 |
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regtest-linearscaling
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-LnPP2
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Adjust tolerances
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2025-04-25 11:36:52 +02:00 |
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regtest-loc_powf
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-lrigpw
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-lrigpw-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-ls-rtp
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Adjusted tolerance
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2025-07-22 14:22:46 +02:00 |
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regtest-lsroks
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-lvlshift
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-md-extrap
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-md-lgvregion
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-meta
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-mom-1
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-mom-2
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Tests: Rename some matchers
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2025-03-08 12:10:39 +01:00 |
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regtest-mp2-1
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-mp2-2
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-mp2-3
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-mp2-4
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CG/Linesearch (#4141)
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2025-04-15 20:13:30 +02:00 |
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regtest-mp2-admm-grad
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-mp2-admm-grad-numer
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-mp2-admm-stress
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-mp2-admm-stress-numer
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-mp2-block
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Tests: Convert TEST_TYPES to matchers.py
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2025-03-01 19:07:38 +01:00 |
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regtest-mp2-grad-1
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Specify numbers of MOs and AOs at different spots (#4295)
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2025-07-16 16:26:39 +02:00 |
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regtest-mp2-grad-2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-mp2-grad-solvers
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-mp2-lr
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-mp2-lr-grad
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-mp2-lr-stress
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-mp2-stress
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-negf
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-negf-fft
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-nlmo
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-nmr-1
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-nmr-2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-nmr-3
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-nmr-4
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-nmr-5
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-nmr-6
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-nmr-uks-1
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-nonortho
|
CG/Linesearch (#4141)
|
2025-04-15 20:13:30 +02:00 |
|
regtest-optbas
|
CG/Linesearch (#4141)
|
2025-04-15 20:13:30 +02:00 |
|
regtest-ot
|
Adjust regtests (#4142)
|
2025-04-16 12:23:35 +02:00 |
|
regtest-ot-1
|
CG/Linesearch (#4141)
|
2025-04-15 20:13:30 +02:00 |
|
regtest-ot-1-vib
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-ot-2
|
CG/Linesearch (#4141)
|
2025-04-15 20:13:30 +02:00 |
|
regtest-ot-refine
|
CG/Linesearch (#4141)
|
2025-04-15 20:13:30 +02:00 |
|
regtest-ot-refine-2
|
CG/Linesearch (#4141)
|
2025-04-15 20:13:30 +02:00 |
|
regtest-ot-refine-3
|
CG/Linesearch (#4141)
|
2025-04-15 20:13:30 +02:00 |
|
regtest-p-efield
|
Adapt tolerances
|
2025-04-24 12:22:23 +02:00 |
|
regtest-pao-1
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-pao-2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-pao-3
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-pao-4
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-pao-5
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-pexsi
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-plus_u
|
CG/Linesearch (#4141)
|
2025-04-15 20:13:30 +02:00 |
|
regtest-pod
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-polar
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-properties/resp
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-ps-implicit-1-1
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-ps-implicit-1-2
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-ps-implicit-1-3
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-ps-implicit-2-1
|
CG/Linesearch (#4141)
|
2025-04-15 20:13:30 +02:00 |
|
regtest-ps-implicit-2-2
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-ps-implicit-2-3
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-rel
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-ri-laplace-mp2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-ri-laplace-mp2-cubic
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-ri-laplace-mp2-cubic-2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-ri-mp2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-ri-mp2-opt
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-ri-rpa
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-ri-rpa-exchange
|
Adjust tolerance of QS/regtest-ri-rpa-exchange/RPA_AXK_H2O_hfx.inp
|
2025-07-22 12:01:49 +02:00 |
|
regtest-ri-rpa-grad
|
Specify numbers of MOs and AOs at different spots (#4295)
|
2025-07-16 16:26:39 +02:00 |
|
regtest-ri-rpa-rse
|
Specify numbers of MOs and AOs at different spots (#4295)
|
2025-07-16 16:26:39 +02:00 |
|
regtest-rixs
|
Resonant Inelastic X-ray Spectroscopy (RIXS) Module
|
2025-07-22 16:39:38 +02:00 |
|
regtest-rma
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-rma-3D
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-rpa-cubic-scaling
|
Interface for greenX library
|
2025-03-14 22:58:29 +01:00 |
|
regtest-rpa-cubic-scaling-2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-rpa-lr
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-rpa-sigma
|
Toolchain: Add GreenX
|
2025-03-28 22:12:22 +01:00 |
|
regtest-rs-dhft
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-rtbse
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-rtbse-gxac
|
RTBSE : Padé FT Refinement
|
2025-04-01 14:20:49 +02:00 |
|
regtest-rtp-1
|
compute the integral of the current density in emd/rtp simulations (#4139)
|
2025-04-14 17:29:11 +02:00 |
|
regtest-rtp-2
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-rtp-3
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-rtp-4
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-rtp-5
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-scalable-gw
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-scalable-gw-restart-1
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-scalable-gw-restart-2
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-scalable-gw-restart-3
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-sccs-1
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-sccs-2
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-sccs-3
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-slab
|
Adjust regtests (#4142)
|
2025-04-16 12:23:35 +02:00 |
|
regtest-smeagol-1
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-smeagol-2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-sos-mp2-grad
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-sos-mp2-lr
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-sparsity
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-spgr
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-spgr-id
|
prettify
|
2025-07-03 16:33:26 +02:00 |
|
regtest-spin-spin-1
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-stda
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-stda-force
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-stda-force-2
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-stda-force-3
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-stda-force-4
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-sto
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-stress
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-sym-1
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-sym-2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-sym-3
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-sym-4
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-sym-5
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-3
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-4
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-admm
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-tddfpt-force
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-tddfpt-force-2
|
Adjust tolerances
|
2025-04-25 11:36:52 +02:00 |
|
regtest-tddfpt-force-3
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-tddfpt-force-gapw
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-force-gapw_xc
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-gapw
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-lri
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-prop
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-tddfpt-soc
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-static
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tddfpt-stda
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-tipscan
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-trexio
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-trexio-2
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-wfn-restart
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
regtest-xastdp
|
Tests: Convert TEST_TYPES to matchers.py
|
2025-03-01 19:07:38 +01:00 |
|
regtest-xc
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |
|
sample_pdb
|
|
|
|
sample_xyz
|
new tests for mixing
|
2016-05-27 15:21:41 +00:00 |
|
untested_inputs
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
|
C.inp
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
|
TEST_FILES.toml
|
Tests: Rename some matchers
|
2025-03-08 12:10:39 +01:00 |