Match comparison for PBE0 Fock Correlation (match type 12505)

Commits > Commit 04b2a32c6063188a192f0d4e38b2e2adad504be9 > Input 03-xc.pbe0_fock.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.521371850000000e-01 3.100000000000000e-06 -2.521395607692308e-01 1.499897235133065e-06 -2.521371800000000e-01 2.819999999986722e-06 PASS

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Detailed information

Reference: -0.252137185, precision: 0.0000031
Run Value Difference Relative difference Status
foss-2022a_ppc -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
cmake_foss_2022a_full_serial -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
cmake_foss_2022a_min_serial -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
cmake_foss_2022a_full_mpi -2.521400000000000e-01 -2.814999999989354e-06 -9.080645161255980e-01 PASS
cmake_foss_2022a_min_mpi -2.521400000000000e-01 -2.814999999989354e-06 -9.080645161255980e-01 PASS
eb_foss-2022a -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
eb_foss-2022a_debug -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
eb_fosscuda-2022a -2.521343600000000e-01 2.824999999984090e-06 9.112903225755130e-01 PASS
eb_foss-2022a_mpi -2.521400000000000e-01 -2.814999999989354e-06 -9.080645161255980e-01 PASS
eb_foss-2022b_libxc6 -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
foss-2022a_opt -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
foss-2022a_omp -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
intel-2022a -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
eb_foss-2022b_libxc6_mpi -2.521400000000000e-01 -2.814999999989354e-06 -9.080645161255980e-01 PASS
intel-2022b -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
eb_foss-2022a_mpi_debug -2.521400000000000e-01 -2.814999999989354e-06 -9.080645161255980e-01 PASS
spack_foss-2022a_serial -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
intel-2022a_omp -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
spack_foss-2022a_serial_min -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
eb_fosscuda-2022a_mpi_omp -2.521343700000000e-01 2.814999999989354e-06 9.080645161255980e-01 PASS
spack_foss-2022a_serial_debug -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
intel-2022a_impi -2.521400000000000e-01 -2.814999999989354e-06 -9.080645161255980e-01 PASS
intel-2022b_impi -2.521400000000000e-01 -2.814999999989354e-06 -9.080645161255980e-01 PASS
foss-2022a_mpi_omp -2.521400000000000e-01 -2.814999999989354e-06 -9.080645161255980e-01 PASS
spack_foss-2022a_serial_omp -2.521399900000000e-01 -2.804999999994617e-06 -9.048387096756830e-01 PASS
intel-2022a_omp_impi -2.521400000000000e-01 -2.814999999989354e-06 -9.080645161255980e-01 PASS