Testing: Split LIBTEST directory

This commit is contained in:
Ole Schütt 2026-03-23 16:37:17 +01:00 committed by Ole Schütt
parent 554bc177a1
commit 44d4b3fceb
46 changed files with 50 additions and 48 deletions

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@ -1,47 +0,0 @@
# runs are executed in the same order as in this file
# the second field tells which test should be run in order to compare with the last available output
# see regtest/TEST_FILES
"test_01.inp" = []
"test_02.inp" = []
"test_pw.inp" = []
"test_pw_02.inp" = []
"test_pw_03.inp" = []
"test_pw_04.inp" = []
"test_pw_05.inp" = []
"test_cp_fm_gemm_01.inp" = []
"test_cp_fm_gemm_02.inp" = []
"eig.inp" = []
"dbcsr_mm_blas.inp" = []
"dbcsr_multistack.inp" = []
"dbcsr_types.inp" = []
"dbcsr_blocks_01.inp" = [{matcher="M058", tol=1.0E-14, ref=20978908949.261906}]
"dbcsr_blocks_02.inp" = [{matcher="M058", tol=1.0E-14, ref=21229174127.238159}]
"dbcsr_blocks_03.inp" = [{matcher="M058", tol=1.0E-14, ref=21561533688.640675}]
"dbcsr_blocks_04.inp" = [{matcher="M058", tol=1.0E-14, ref=21304439095.77774}]
"dbcsr_blocks_05.inp" = [{matcher="M058", tol=1.0E-14, ref=21455488291.450737}]
"dbcsr_blocks_06.inp" = [{matcher="M058", tol=1.0E-14, ref=165599.60719889530}]
"dbcsr_types_01.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_types_02.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_types_03.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_types_04.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_types_05.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_io_1.inp" = []
"dbcsr_order_N.inp" = [{matcher="M058", tol=1.0E-14, ref=1910924.8949438382}]
"dbm_blocks_01.inp" = [{matcher="M058", tol=5.0E-14, ref=20978908949.261906}]
"dbm_blocks_02.inp" = [{matcher="M058", tol=5.0E-14, ref=21229174127.238159}]
"dbm_blocks_03.inp" = [{matcher="M058", tol=5.0E-14, ref=21561533688.640675}]
"dbm_blocks_04.inp" = [{matcher="M058", tol=5.0E-14, ref=21304439095.77774}]
"dbm_blocks_05.inp" = [{matcher="M058", tol=5.0E-14, ref=21455488291.450737}]
"dbm_blocks_06.inp" = [{matcher="M058", tol=5.0E-14, ref=165599.60719889530}]
"dbm_order_N.inp" = [{matcher="M058", tol=5.0E-14, ref=1910924.8949438382}]
"test_eri_mme_accuracy.inp" = []
"test_eri_mme_accuracy_longrange.inp" = []
"test_eri_mme_accuracy_yukawa.inp" = []
"test_eri_mme_performance.inp" = []
"test_minimax.inp" = []
"test_shg_integrals_01.inp" = []
"test_shg_integrals_02.inp" = []
#EOF

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@ -0,0 +1,18 @@
"dbcsr_mm_blas.inp" = []
"dbcsr_multistack.inp" = []
"dbcsr_types.inp" = []
"dbcsr_blocks_01.inp" = [{matcher="M058", tol=1.0E-14, ref=20978908949.261906}]
"dbcsr_blocks_02.inp" = [{matcher="M058", tol=1.0E-14, ref=21229174127.238159}]
"dbcsr_blocks_03.inp" = [{matcher="M058", tol=1.0E-14, ref=21561533688.640675}]
"dbcsr_blocks_04.inp" = [{matcher="M058", tol=1.0E-14, ref=21304439095.77774}]
"dbcsr_blocks_05.inp" = [{matcher="M058", tol=1.0E-14, ref=21455488291.450737}]
"dbcsr_blocks_06.inp" = [{matcher="M058", tol=1.0E-14, ref=165599.60719889530}]
"dbcsr_types_01.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_types_02.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_types_03.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_types_04.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_types_05.inp" = [{matcher="M058", tol=1.0E-14, ref=215164151.09111807}]
"dbcsr_io_1.inp" = []
"dbcsr_order_N.inp" = [{matcher="M058", tol=1.0E-14, ref=1910924.8949438382}]
#EOF

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@ -0,0 +1,9 @@
"dbm_blocks_01.inp" = [{matcher="M058", tol=5.0E-14, ref=20978908949.261906}]
"dbm_blocks_02.inp" = [{matcher="M058", tol=5.0E-14, ref=21229174127.238159}]
"dbm_blocks_03.inp" = [{matcher="M058", tol=5.0E-14, ref=21561533688.640675}]
"dbm_blocks_04.inp" = [{matcher="M058", tol=5.0E-14, ref=21304439095.77774}]
"dbm_blocks_05.inp" = [{matcher="M058", tol=5.0E-14, ref=21455488291.450737}]
"dbm_blocks_06.inp" = [{matcher="M058", tol=5.0E-14, ref=165599.60719889530}]
"dbm_order_N.inp" = [{matcher="M058", tol=5.0E-14, ref=1910924.8949438382}]
#EOF

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@ -0,0 +1,20 @@
"test_01.inp" = []
"test_02.inp" = []
"test_pw.inp" = []
"test_pw_02.inp" = []
"test_pw_03.inp" = []
"test_pw_04.inp" = []
"test_pw_05.inp" = []
"test_cp_fm_gemm_01.inp" = []
"test_cp_fm_gemm_02.inp" = []
"eig.inp" = []
"test_eri_mme_accuracy.inp" = []
"test_eri_mme_accuracy_longrange.inp" = []
"test_eri_mme_accuracy_yukawa.inp" = []
"test_eri_mme_performance.inp" = []
"test_minimax.inp" = []
"test_shg_integrals_01.inp" = []
"test_shg_integrals_02.inp" = []
#EOF

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@ -91,7 +91,9 @@ QS/regtest-sym-5
QS/regtest-cdft-diag
QS/regtest-kp-hfx-ri-admm-2 libint !ifx
QS/regtest-plus_u
LIBTEST
LIBTEST/dbcsr
LIBTEST/dbm
LIBTEST/misc
QS/regtest-stda-force libint !ifx
QS/regtest-ls-rtp
QS/regtest-ot-1