Match comparison for External energy (match type 22293)

Commits > Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf > Input 22-berry.01-cubic_Si_gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-5.603089620000000e+00 2.800000000000000e-07 -5.603089622222223e+00 1.474055493343071e-08 -5.603089620000000e+00 2.000000032253979e-08 PASS
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Detailed information

Reference: -5.60308962, precision: 0.00000028
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
spack_foss-2022a_serial -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
spack_foss-2023a_serial_min -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
spack_foss-2023a_serial -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
cmake_foss_2022a_full_serial -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
spack_foss-2022a_ppc -5.603089620000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_min -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_foss-2022a_mpi_min -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
cmake_foss_2022a_full_mpi -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_foss-2023a_serial_debug -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
spack_foss-2023a_mpi_opt -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_foss-2022a_mpi -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_foss-2023a_mpi -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_foss-2022a_cuda_serial -5.603089630000000e+00 -9.999999939225290e-09 -3.571428549723318e-02 PASS
cmake_foss_2022a_min_mpi -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_foss-2023a_mpi_debug -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_foss-2023a_mpi_omp -5.603089600000000e+00 2.000000076662900e-08 7.142857416653214e-02 PASS
spack_foss-2022a_cuda_mpi_omp -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
cmake_foss_2022a_min_serial -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
spack_foss-2023a_serial_opt -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
spack_foss-2023b_serial -5.603089640000000e+00 -1.999999987845058e-08 -7.142857099446635e-02 PASS
spack_foss-2023a_serial_omp -5.603089600000000e+00 2.000000076662900e-08 7.142857416653214e-02 PASS
spack_intel-2023a_serial -5.603089620000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_intel-2023a_serial_omp -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_intel-2023a_impi -5.603089610000000e+00 1.000000082740371e-08 3.571428866929896e-02 PASS
spack_intel-2022a_impi_omp -5.603089620000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS