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more kernels (Peter) and additional dbcsr libtests.
svn-origin-rev: 13305
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parent
1be4207c58
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4a63ebbdd6
12 changed files with 177 additions and 14 deletions
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@ -18,7 +18,9 @@ def main():
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triples = combinations(5,13) # amorph spiro-MeOTAD
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triples += combinations(13,26) # TiO2
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triples += combinations(23) # blocked H2O
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triples += combinations(13,24,54) # blocked acetonitrile
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triples += combinations(13,24,5) # non-blocked acetonitrile +TiO2-v2
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triples += combinations(13,24,54) # blocked-v1 acetonitrile +TiO2-v2
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triples += combinations(13,24,15) # blocked-v2 acetonitrile +TiO2-v2
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usage = "Generator of LibCuSMM. The Library for Cuda Small Matrix Multiplications."
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parser = OptionParser(usage)
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@ -52,5 +52,40 @@
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Kernel_dnt_medium(m=13, n=24, k=24, threads=160, tile_m=1, tile_n=2, panel_in=160, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=13, n=24, k=13, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=13, n=13, k=24, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=24, k=15, threads=128, tile_m=2, tile_n=3, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=13, k=15, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=15, k=24, threads=160, tile_m=2, tile_n=2, panel_in=160, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=15, k=13, threads=96, tile_m=2, tile_n=2, panel_in=96, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=15, k=15, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=13, n=24, k=15, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=13, n=13, k=15, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=13, n=15, k=24, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=13, n=15, k=13, threads=96, tile_m=2, tile_n=2, panel_in=96, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=13, n=15, k=15, threads=96, tile_m=2, tile_n=2, panel_in=96, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=15, n=24, k=24, threads=160, tile_m=2, tile_n=2, panel_in=160, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=15, n=24, k=13, threads=96, tile_m=2, tile_n=2, panel_in=96, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=15, n=24, k=15, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=15, n=13, k=24, threads=128, tile_m=2, tile_n=1, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=15, n=13, k=13, threads=96, tile_m=4, tile_n=1, panel_in=96, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=15, n=13, k=15, threads=96, tile_m=2, tile_n=2, panel_in=96, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=15, n=15, k=24, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=15, n=15, k=13, threads=128, tile_m=2, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=15, n=15, k=15, threads=128, tile_m=1, tile_n=2, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=24, k=5, threads=128, tile_m=2, tile_n=3, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=13, k=5, threads=160, tile_m=3, tile_n=1, panel_in=160, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=5, k=24, threads=128, tile_m=1, tile_n=1, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=5, k=13, threads=128, tile_m=1, tile_n=1, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=24, n=5, k=5, threads=160, tile_m=1, tile_n=2, panel_in=160, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=13, n=24, k=5, threads=192, tile_m=1, tile_n=2, panel_in=192, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=13, n=5, k=24, threads=128, tile_m=1, tile_n=1, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=5, n=24, k=24, threads=160, tile_m=1, tile_n=1, panel_in=160, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=5, n=24, k=13, threads=128, tile_m=1, tile_n=1, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=5, n=24, k=5, threads=192, tile_m=1, tile_n=2, panel_in=192, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=5, n=13, k=24, threads=128, tile_m=1, tile_n=1, panel_in=128, panel_out=0 ,grouping=16),
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Kernel_dnt_medium(m=5, n=5, k=24, threads=192, tile_m=1, tile_n=1, panel_in=192, panel_out=0 ,grouping=16),
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]
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#EOF
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@ -15,3 +15,8 @@ dbcsr_mm_blas.inp 0
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dbcsr_subcomm.inp 0
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dbcsr_multistack.inp 0
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dbcsr_types.inp 0
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dbcsr_blocks_01.inp 58
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dbcsr_blocks_02.inp 58
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dbcsr_blocks_03.inp 58
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dbcsr_blocks_04.inp 58
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dbcsr_blocks_05.inp 58
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24
tests/LIBTEST/dbcsr_blocks_01.inp
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24
tests/LIBTEST/dbcsr_blocks_01.inp
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@ -0,0 +1,24 @@
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&GLOBAL
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PRINT_LEVEL MEDIUM
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PROGRAM_NAME TEST
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RUN_TYPE NONE
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&TIMINGS
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THRESHOLD 0.00000000001
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&END
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&END GLOBAL
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&TEST
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&CP_DBCSR
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K 800
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M 800
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N 800
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TRANSA FALSE
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TRANSB TRUE
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N_LOOP 2
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ASPARSITY 0.05
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BSPARSITY 0.05
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CSPARSITY 0.05
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bs_m 1 13 1 5 1 24
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bs_k 1 13 1 5 1 24
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bs_n 1 13 1 5 1 24
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&END
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&END TEST
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24
tests/LIBTEST/dbcsr_blocks_02.inp
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24
tests/LIBTEST/dbcsr_blocks_02.inp
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@ -0,0 +1,24 @@
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&GLOBAL
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PRINT_LEVEL MEDIUM
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PROGRAM_NAME TEST
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RUN_TYPE NONE
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&TIMINGS
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THRESHOLD 0.00000000001
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&END
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&END GLOBAL
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&TEST
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&CP_DBCSR
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K 800
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M 800
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N 800
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TRANSA FALSE
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TRANSB TRUE
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N_LOOP 2
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ASPARSITY 0.05
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BSPARSITY 0.05
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CSPARSITY 0.05
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bs_m 1 13 1 24 1 15
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bs_k 1 13 1 24 1 15
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bs_n 1 13 1 24 1 15
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&END
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&END TEST
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24
tests/LIBTEST/dbcsr_blocks_03.inp
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24
tests/LIBTEST/dbcsr_blocks_03.inp
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@ -0,0 +1,24 @@
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&GLOBAL
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PRINT_LEVEL MEDIUM
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PROGRAM_NAME TEST
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RUN_TYPE NONE
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&TIMINGS
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THRESHOLD 0.00000000001
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&END
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&END GLOBAL
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&TEST
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&CP_DBCSR
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K 800
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M 800
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N 800
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TRANSA FALSE
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TRANSB TRUE
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N_LOOP 2
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ASPARSITY 0.05
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BSPARSITY 0.05
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CSPARSITY 0.05
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bs_m 1 13 1 24 1 54
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bs_k 1 13 1 24 1 54
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bs_n 1 13 1 24 1 54
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&END
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&END TEST
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24
tests/LIBTEST/dbcsr_blocks_04.inp
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24
tests/LIBTEST/dbcsr_blocks_04.inp
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@ -0,0 +1,24 @@
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&GLOBAL
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PRINT_LEVEL MEDIUM
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PROGRAM_NAME TEST
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RUN_TYPE NONE
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&TIMINGS
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THRESHOLD 0.00000000001
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&END
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&END GLOBAL
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&TEST
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&CP_DBCSR
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K 800
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M 800
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N 800
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TRANSA FALSE
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TRANSB TRUE
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N_LOOP 2
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ASPARSITY 0.05
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BSPARSITY 0.05
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CSPARSITY 0.05
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bs_m 1 23
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bs_k 1 23
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bs_n 1 23
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&END
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&END TEST
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24
tests/LIBTEST/dbcsr_blocks_05.inp
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24
tests/LIBTEST/dbcsr_blocks_05.inp
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@ -0,0 +1,24 @@
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&GLOBAL
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PRINT_LEVEL MEDIUM
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PROGRAM_NAME TEST
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RUN_TYPE NONE
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&TIMINGS
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THRESHOLD 0.00000000001
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&END
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&END GLOBAL
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&TEST
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&CP_DBCSR
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K 800
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M 800
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N 800
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TRANSA FALSE
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TRANSB TRUE
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N_LOOP 2
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ASPARSITY 0.05
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BSPARSITY 0.05
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CSPARSITY 0.05
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bs_m 1 26 1 13 1 54
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bs_k 1 26 1 13 1 54
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bs_n 1 26 1 13 1 54
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&END
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&END TEST
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@ -11,12 +11,12 @@
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&END GLOBAL
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&TEST
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&CP_DBCSR
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K 512
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M 5120
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N 512
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K 500
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M 200
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N 500
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TRANSA FALSE
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TRANSB TRUE
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N_LOOP 10
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N_LOOP 3
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ASPARSITY 0.05
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BSPARSITY 0.05
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CSPARSITY 0.05
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@ -11,12 +11,12 @@
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&END GLOBAL
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&TEST
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&CP_DBCSR
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K 512
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M 5120
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N 512
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K 300
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M 170
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N 200
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TRANSA FALSE
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TRANSB TRUE
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N_LOOP 10
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N_LOOP 3
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ASPARSITY 0.05
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BSPARSITY 0.05
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CSPARSITY 0.05
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@ -11,12 +11,12 @@
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&END GLOBAL
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&TEST
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&CP_DBCSR
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K 512
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M 5120
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N 512
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K 50
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M 165
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N 300
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TRANSA FALSE
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TRANSB TRUE
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N_LOOP 10
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N_LOOP 2
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ASPARSITY 0.05
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BSPARSITY 0.05
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CSPARSITY 0.05
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@ -1,4 +1,4 @@
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57
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58
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Total energy:!3
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POTENTIAL ENERGY!4
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Total energy \[eV\]:!4
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@ -56,6 +56,7 @@ GRAND TOTAL FORCE !7
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BASOPT| Total residuum value: !5
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Final value of function !6
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Emp2-RI = !3
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Final checksums !3
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#
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# these are the tests the can be selected for regtesting.
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# do regtest will grep for test_grep (first column) and look if the numeric value
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