| .. |
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regtest-admm-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-admm-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-admm-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-admm-4
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Bug fix screening in hfx_derivatives (#3221)
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2024-01-16 16:00:43 +01:00 |
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regtest-admm-dm
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-admm-gapw
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Bug fix screening in hfx_derivatives (#3221)
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2024-01-16 16:00:43 +01:00 |
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regtest-admm-libxc
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-admm-qps
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-admm-qps-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-admm-type
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Fix simplified ADMM input
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2023-12-19 11:41:21 +01:00 |
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regtest-all-electron
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restructure E_DENSITY_CUBE printing procedure and default behavior (#3289)
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2024-03-01 12:04:59 +01:00 |
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regtest-almo-1
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-almo-2
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Disable ELPA for tests/QS/regtest-almo-2/ion-pair.inp
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2024-03-09 00:28:34 +01:00 |
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regtest-almo-eda
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-almo-md
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-almo-strong
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-almo-trustr
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-as
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-as-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-as-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-as-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-as-dft
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-bs
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-bse
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Add optical properties from BSE and improve cutoff handling
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2024-08-01 17:20:12 +02:00 |
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regtest-cdft-1
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-2
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-3
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-3-1
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-4-1
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-4-2
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-4-3
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-5
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-diag
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-hirshfeld
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-hirshfeld-2
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-cdft-hirshfeld-3
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-chi-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-corr_dipm
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-cusolver
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-dcdft-force
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Bug fix screening in hfx_derivatives (#3221)
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2024-01-16 16:00:43 +01:00 |
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regtest-dcdft-hfx
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Stabilize QS/regtest-dcdft-hfx/N2_t05.inp
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2024-08-03 16:45:58 +02:00 |
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regtest-dcdft-stress
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Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-dcdr
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-debug-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-debug-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-debug-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-debug-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-debug-5
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-debug-6
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Accelerate slow tests; add debug tags in output
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2024-01-26 13:38:30 +01:00 |
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regtest-debug-7
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-dft-filtermat
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-dft-vdw-corr-1
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-dft-vdw-corr-2
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-dft-vdw-corr-3
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-dft-vdw-corr-4
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adding optional D4 support (#3501)
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2024-06-27 16:09:28 +02:00 |
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regtest-dlaf
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-dm-ls-scf-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-dm-ls-scf-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-dm-ls-scf-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-dm-ls-scf-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-grad
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-grad-laplace
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-grad-meta
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-grad-numer
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-grad-numer-meta
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-stress
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-stress-laplace
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-stress-meta
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-stress-numer
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-stress-numer-laplace
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-double-hybrid-stress-numer-meta
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ec
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Bug fix screening in hfx_derivatives (#3221)
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2024-01-16 16:00:43 +01:00 |
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regtest-ec-force
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Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-ec-meta
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ec-stress
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Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-ecp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ecp-2
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ECP nuclear gradients
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2024-01-11 10:26:31 +01:00 |
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regtest-ed
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-elpa
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-elpa-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-elpa-qr
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-embed
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-epr-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-epr-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-fftw
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-fftw-wisdom
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Fix initialization of FFTW
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2024-06-24 11:26:40 +02:00 |
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regtest-gapw
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gapw-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gapw-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gapw-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gapw-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gapw-ext
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gapw_xc
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Sync pseudopotential database files with cp2k-data repository
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2024-04-03 13:26:41 +02:00 |
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regtest-gpw-1
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-gpw-2-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gpw-2-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gpw-2-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gpw-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gpw-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gpw-5
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gpw-6-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gpw-6-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gpw-6-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gpw-7
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-gpw-8
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Update regtests (#3226)
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2024-01-17 11:52:32 +01:00 |
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regtest-gpw-9
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-grid
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gw
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simplified GW self-consistency input
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2024-07-11 23:03:19 +02:00 |
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regtest-gw-cubic
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simplified GW self-consistency input
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2024-07-11 23:03:19 +02:00 |
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regtest-gw-ic-model
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gw-kpoints
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-gw2x
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hf-3c
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hfx
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hfx-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hfx-block
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hfx-bug-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hfx-periodic
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Bug fix screening in hfx_derivatives (#3221)
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2024-01-16 16:00:43 +01:00 |
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regtest-hfx-ri
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Adapt tolerances for testing
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2024-01-30 10:18:36 +01:00 |
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regtest-hfx-ri-2
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Bug fix screening in hfx_derivatives (#3221)
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2024-01-16 16:00:43 +01:00 |
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regtest-hfx-stress
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Bug fix screening in hfx_derivatives (#3221)
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2024-01-16 16:00:43 +01:00 |
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regtest-hfx-wfn-fitting
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hirshfeld
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hole-funct
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hybrid-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hybrid-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hybrid-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-hybrid-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-iao
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-kg
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-kind
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-kp-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-kp-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-kp-3
|
Infrastructure for Kpoint symmetries (#3482)
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2024-06-18 09:37:39 +02:00 |
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regtest-kp-hfx-ri
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-kp-hfx-ri-2
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Bug fix screening in hfx_derivatives (#3221)
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2024-01-16 16:00:43 +01:00 |
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regtest-kp-hfx-ri-admm
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-kp-hfx-ri-admm-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-libxc
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-linearscaling
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-LnPP2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-loc_powf
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-lrigpw
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-lrigpw-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ls-rtp
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-lsroks
|
Remove regtest for print Wannier and Cube in LOW SPIN ROKS
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2024-04-26 11:32:56 +02:00 |
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regtest-lvlshift
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-md-extrap
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-md-lgvregion
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-meta
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-mom-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-mom-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-mp2-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-mp2-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-mp2-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-mp2-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-mp2-admm-grad
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-admm-grad-numer
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-admm-stress
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-admm-stress-numer
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-block
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-grad-1
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-grad-2
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-grad-solvers
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-lr
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-mp2-lr-grad
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-lr-stress
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Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-mp2-stress
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-negf
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-negf-fft
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-nlmo
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-nmr-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-nmr-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-nmr-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-nmr-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-nmr-5
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-nmr-6
|
Adjust 5 regtests
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2024-03-22 21:42:41 +01:00 |
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regtest-nmr-uks-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-nonortho
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-optbas
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ot
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ot-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ot-1-vib
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ot-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ot-refine
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ot-refine-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ot-refine-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-p-efield
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-pao-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-pao-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-pao-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-pao-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-pexsi
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-plus_u
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Update reference values
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2024-01-22 12:11:07 +01:00 |
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regtest-pod
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-polar
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-properties/resp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ps-implicit-1-1
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-ps-implicit-1-2
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-ps-implicit-1-3
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-ps-implicit-2-1
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-ps-implicit-2-2
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-ps-implicit-2-3
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Indent @-directives and set them upercase
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2024-01-16 16:23:54 +01:00 |
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regtest-rel
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ri-laplace-mp2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ri-laplace-mp2-cubic
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ri-laplace-mp2-cubic-2
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Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-ri-mp2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ri-mp2-opt
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ri-rpa
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-ri-rpa-exchange
|
Add -march compiler flag for CPUID recognition (#3570)
|
2024-07-26 07:46:47 +02:00 |
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regtest-ri-rpa-grad
|
Add -march compiler flag for CPUID recognition (#3570)
|
2024-07-26 07:46:47 +02:00 |
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regtest-ri-rpa-rse
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-rma
|
Updated ref values for HFX response forces
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2024-01-18 10:05:27 +01:00 |
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regtest-rma-3D
|
Updated ref values for HFX response forces
|
2024-01-18 10:05:27 +01:00 |
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regtest-rpa-cubic-scaling
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-rpa-cubic-scaling-2
|
Updated ref values for HFX response forces
|
2024-01-18 10:05:27 +01:00 |
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regtest-rpa-lr
|
Fix AXK implementation and extend it to SOSEX (#3468)
|
2024-06-12 21:44:46 +02:00 |
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regtest-rs-dhft
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-rtp-1
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-rtp-2
|
projection on reference in RTP (#3298)
|
2024-03-05 11:23:13 +01:00 |
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regtest-rtp-3
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-rtp-4
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-rtp-5
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-scalable-gw
|
improve convergence of GW bandstructure calculation & improve manual
|
2024-07-30 10:21:02 +02:00 |
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regtest-scalable-gw-restart-1
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-scalable-gw-restart-2
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-scalable-gw-restart-3
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-sccs-1
|
Indent @-directives and set them upercase
|
2024-01-16 16:23:54 +01:00 |
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regtest-sccs-2
|
Indent @-directives and set them upercase
|
2024-01-16 16:23:54 +01:00 |
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regtest-sccs-3
|
Indent @-directives and set them upercase
|
2024-01-16 16:23:54 +01:00 |
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regtest-slab
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
|
regtest-sos-mp2-grad
|
Updated ref values for HFX response forces
|
2024-01-18 10:05:27 +01:00 |
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regtest-sos-mp2-lr
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-sparsity
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-spgr
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-spin-spin-1
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-stda
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-stda-force
|
Bug fix screening in hfx_derivatives (#3221)
|
2024-01-16 16:00:43 +01:00 |
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regtest-stda-force-2
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
|
regtest-stda-force-3
|
Bug fix screening in hfx_derivatives (#3221)
|
2024-01-16 16:00:43 +01:00 |
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regtest-stda-force-4
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-sto
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-stress
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Format all input files
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2023-12-18 22:41:19 +01:00 |
|
regtest-sym-1
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-sym-2
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-sym-3
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-sym-4
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-sym-5
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
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regtest-tddfpt
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-tddfpt-2
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-tddfpt-3
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
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regtest-tddfpt-4
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
|
regtest-tddfpt-admm
|
Update regtests (#3226)
|
2024-01-17 11:52:32 +01:00 |
|
regtest-tddfpt-force
|
Bug fix screening in hfx_derivatives (#3221)
|
2024-01-16 16:00:43 +01:00 |
|
regtest-tddfpt-force-2
|
Adjust 5 regtests
|
2024-03-22 21:42:41 +01:00 |
|
regtest-tddfpt-force-3
|
Updated ref values for HFX response forces
|
2024-01-18 10:05:27 +01:00 |
|
regtest-tddfpt-force-gapw
|
TDA Kernel methods (#3273)
|
2024-02-19 14:14:08 +01:00 |
|
regtest-tddfpt-force-gapw_xc
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
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regtest-tddfpt-gapw
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
|
regtest-tddfpt-lri
|
Adjust tolerances (Zen 2)
|
2024-07-16 16:28:19 +02:00 |
|
regtest-tddfpt-prop
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
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regtest-tddfpt-soc
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
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regtest-tddfpt-stda
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
|
regtest-tipscan
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
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regtest-wfn-restart
|
Format all input files
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2023-12-18 22:41:19 +01:00 |
|
regtest-xastdp
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
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regtest-xc
|
Format all input files
|
2023-12-18 22:41:19 +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 |
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C.inp
|
Format all input files
|
2023-12-18 22:41:19 +01:00 |
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TEST_FILES
|
prettify TEST_FILES files
|
2015-08-28 11:26:53 +00:00 |
