Match comparison for Total energy (match type 27129)

Commits > Commit dfb998a08bfe04488932b5e2d20d2b9995cc9a79 > Input 02-ACBN0.01-nio.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.870867399400000e+02 4.710000000000000e-05 -2.870867398668966e+02 2.590236443902441e-06 -2.870867367200000e+02 6.500000012010787e-06 PASS

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Detailed information

Reference: -287.08673994000003, precision: 0.0000471
Run Value Difference Relative difference Status
foss-2022a_ppc -2.870867407500000e+02 -8.099999604382901e-07 -1.719745138934799e-02 PASS
cmake_foss_2022a_full_serial -2.870867302200000e+02 9.720000036850251e-06 2.063694275339756e-01 PASS
foss-2022a_opt -2.870867424100000e+02 -2.469999969889614e-06 -5.244161294882407e-02 PASS
intel-2022a -2.870867420600000e+02 -2.119999976457621e-06 -4.501061521141445e-02 PASS
cmake_foss_2022a_full_mpi -2.870867376400000e+02 2.300000005561742e-06 4.883227188029176e-02 PASS
cmake_foss_2022a_min_serial -2.870867387900000e+02 1.150000002780871e-06 2.441613594014588e-02 PASS
foss-2022a_omp -2.870867415400000e+02 -1.599999961854337e-06 -3.397027519860588e-02 PASS
cmake_foss_2022a_min_mpi -2.870867407400000e+02 -7.999999525054591e-07 -1.698513699586962e-02 PASS
eb_fosscuda-2022a -2.870867363500000e+02 3.590000005715410e-06 7.622080691540149e-02 PASS
intel-2022a_impi -2.870867394300000e+02 5.100000066704524e-07 1.082802561933020e-02 PASS
eb_foss-2022a -2.870867424100000e+02 -2.469999969889614e-06 -5.244161294882407e-02 PASS
spack_foss-2022a_cuda_mpi_omp -2.870867432200000e+02 -3.279999987171323e-06 -6.963906554503869e-02 PASS
eb_foss-2022a_debug -2.870867424100000e+02 -2.469999969889614e-06 -5.244161294882407e-02 PASS
eb_foss-2022b_libxc6 -2.870867402300000e+02 -2.899999458350067e-07 -6.157111376539419e-03 PASS
eb_foss-2022a_mpi -2.870867409100000e+02 -9.699999736767495e-07 -2.059447927126857e-02 PASS
foss-2022a_mpi_omp -2.870867400000000e+02 -5.999999075356754e-08 -1.273885154003557e-03 PASS
eb_foss-2022b_libxc6_mpi -2.870867349500000e+02 4.990000036286801e-06 1.059447990719066e-01 PASS
intel-2022b -2.870867420600000e+02 -2.119999976457621e-06 -4.501061521141445e-02 PASS
eb_foss-2022a_mpi_debug -2.870867409100000e+02 -9.699999736767495e-07 -2.059447927126857e-02 PASS
spack_foss-2022a_serial -2.870867387900000e+02 1.150000002780871e-06 2.441613594014588e-02 PASS
intel-2022a_omp -2.870867412500000e+02 -1.309999959175911e-06 -2.781316261519982e-02 PASS
spack_foss-2022a_mpi -2.870867407400000e+02 -7.999999525054591e-07 -1.698513699586962e-02 PASS
spack_foss-2022a_serial_debug -2.870867387900000e+02 1.150000002780871e-06 2.441613594014588e-02 PASS
spack_foss-2022a_serial_min -2.870867387900000e+02 1.150000002780871e-06 2.441613594014588e-02 PASS
intel-2022b_impi -2.870867394300000e+02 5.100000066704524e-07 1.082802561933020e-02 PASS
spack_foss-2022a_serial_omp -2.870867409800000e+02 -1.039999972363148e-06 -2.208067881875049e-02 PASS
spack_foss-2022a_serial_opt -2.870867387900000e+02 1.150000002780871e-06 2.441613594014588e-02 PASS
spack_foss-2022a_mpi_omp -2.870867415900000e+02 -1.649999944675073e-06 -3.503184595913107e-02 PASS
intel-2022a_omp_impi -2.870867399600000e+02 -1.999995902224327e-08 -4.246275800900908e-04 PASS