Match comparison for Total energy (match type 26095)

Commits > Commit 6816b153d33f61198d1ef96fd0f4ab733dba1073 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184209376000000e+02 1.300000000000000e-04 -3.184210113552941e+02 8.910135234649130e-05 -3.184209459500000e+02 1.267300000051819e-04 FAIL

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Detailed information

Reference: -318.4209376, precision: 0.00013
Run Value Difference Relative difference Status
foss-2022a_ppc -3.184210514600000e+02 -1.138599999990220e-04 -8.758461538386306e-01 PASS
spack_foss-2022a_serial -3.184208192200000e+02 1.183800000035262e-04 9.106153846425095e-01 PASS
foss-2022a_opt -3.184210489300000e+02 -1.113299999815354e-04 -8.563846152425798e-01 PASS
spack_foss-2022a_serial_min -3.184208192200000e+02 1.183800000035262e-04 9.106153846425095e-01 PASS
eb_foss-2022a -3.184210482000000e+02 -1.105999999708729e-04 -8.507692305451762e-01 PASS
foss-2022a_omp -3.184210512000000e+02 -1.136000000201420e-04 -8.738461540010927e-01 PASS
spack_foss-2022a_serial_debug -3.184208192200000e+02 1.183800000035262e-04 9.106153846425095e-01 PASS
eb_foss-2022b_libxc6 -3.184210559900000e+02 -1.183900000114591e-04 -9.106923077804543e-01 PASS
eb_fosscuda-2022a -3.184210509100000e+02 -1.133100000174636e-04 -8.716153847497201e-01 PASS
spack_foss-2022a_serial_omp -3.184210514200000e+02 -1.138200000241341e-04 -8.755384617241082e-01 PASS
eb_foss-2022a_debug -3.184210482000000e+02 -1.105999999708729e-04 -8.507692305451762e-01 PASS
spack_foss-2022a_serial_opt -3.184210505400000e+02 -1.129400000081660e-04 -8.687692308320458e-01 PASS
eb_foss-2022a_mpi -3.184210508400000e+02 -1.132400000187772e-04 -8.710769232213632e-01 PASS
eb_foss-2022b_libxc6_mpi -3.184210726800000e+02 -1.350800000068375e-04 -1.039076923129519e+00 FAIL
eb_fosscuda-2022a_mpi_omp -3.184210516800000e+02 -1.140800000030140e-04 -8.775384615616462e-01 PASS
eb_foss-2022a_mpi_debug -3.184210516700000e+02 -1.140699999950812e-04 -8.774615384237013e-01 PASS
foss-2022a_mpi_omp -3.184210516600000e+02 -1.140599999871483e-04 -8.773846152857565e-01 PASS