Match comparison for Exchange energy (match type 22802)

Commits > Commit bf0f47cf3302df97f9487d18148dd4e0cf599eb9 > Input 12-boron_nitride.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.748201280100000e+02 2.670000000000000e-06 -1.748201267744445e+02 9.202791279694978e-08 -1.748201266800000e+02 2.100000102700506e-07 PASS

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -174.82012801000002, precision: 0.00000267
Run Value Difference Relative difference Status
foss-2022a_ppc -1.748201264700000e+02 1.540000027944188e-06 5.767790366832166e-01 PASS
cmake_foss_2022a_full_serial -1.748201267500000e+02 1.260000033198594e-06 4.719101247934809e-01 PASS
cmake_foss_2022a_min_serial -1.748201267500000e+02 1.260000033198594e-06 4.719101247934809e-01 PASS
cmake_foss_2022a_full_mpi -1.748201267600000e+02 1.250000025265763e-06 4.681648034703232e-01 PASS
eb_fosscuda-2022a -1.748201268000000e+02 1.210000021956148e-06 4.531835288225274e-01 PASS
cmake_foss_2022a_min_mpi -1.748201267600000e+02 1.250000025265763e-06 4.681648034703232e-01 PASS
eb_foss-2022a -1.748201267600000e+02 1.250000025265763e-06 4.681648034703232e-01 PASS
eb_foss-2022a_debug -1.748201267600000e+02 1.250000025265763e-06 4.681648034703232e-01 PASS
eb_foss-2022b_libxc6 -1.748201268600000e+02 1.150000031202580e-06 4.307116221732511e-01 PASS
eb_foss-2022a_mpi -1.748201267600000e+02 1.250000025265763e-06 4.681648034703232e-01 PASS
foss-2022a_opt -1.748201267600000e+02 1.250000025265763e-06 4.681648034703232e-01 PASS
foss-2022a_omp -1.748201267700000e+02 1.240000017332932e-06 4.644194821471655e-01 PASS
eb_foss-2022b_libxc6_mpi -1.748201268500000e+02 1.160000010713702e-06 4.344569328515738e-01 PASS
intel-2022a -1.748201268900000e+02 1.120000007404087e-06 4.194756582037780e-01 PASS
eb_foss-2022a_mpi_debug -1.748201267600000e+02 1.250000025265763e-06 4.681648034703232e-01 PASS
intel-2022b -1.748201268900000e+02 1.120000007404087e-06 4.194756582037780e-01 PASS
eb_fosscuda-2022a_mpi_omp -1.748201268400000e+02 1.170000018646533e-06 4.382022541747315e-01 PASS
spack_foss-2022a_serial -1.748201267500000e+02 1.260000033198594e-06 4.719101247934809e-01 PASS
intel-2022a_omp -1.748201268400000e+02 1.170000018646533e-06 4.382022541747315e-01 PASS
intel-2022a_impi -1.748201268900000e+02 1.120000007404087e-06 4.194756582037780e-01 PASS
spack_foss-2022a_serial_min -1.748201267500000e+02 1.260000033198594e-06 4.719101247934809e-01 PASS
foss-2022a_mpi_omp -1.748201267500000e+02 1.260000033198594e-06 4.719101247934809e-01 PASS
intel-2022b_impi -1.748201268900000e+02 1.120000007404087e-06 4.194756582037780e-01 PASS
spack_foss-2022a_serial_debug -1.748201267500000e+02 1.260000033198594e-06 4.719101247934809e-01 PASS
spack_foss-2022a_serial_omp -1.748201267900000e+02 1.220000029888979e-06 4.569288501456851e-01 PASS
eb_foss-2022a_valgrind -1.748201265400000e+02 1.470000029257790e-06 5.505618087107828e-01 PASS
intel-2022a_omp_impi -1.748201267700000e+02 1.240000017332932e-06 4.644194821471655e-01 PASS