Match comparison for M-solvent int. energy @ t=0 (match type 12046)
Commits >
Commit bb686499811dbfe67b92ca3aeb5b2659998636fa >
Input 32-tdpcm_methane.03-td_prop_eom.inp
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-1.495587625573000e-02 | 1.000000000000000e-04 | -1.501569625167089e-02 | 7.563337494701382e-14 | -1.501569625161315e-02 | 1.691797743563761e-13 | PASS |
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Detailed information
Reference: -0.01495587625573, precision: 0.0001Run | Value | Difference | Relative difference | Status |
cmake_foss_2022a_full_serial | -1.501569625161315e-02 | -5.981999588315461e-05 | -5.981999588315460e-01 | PASS |
spack_foss-2022a_serial_min | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
spack_foss-2022a_serial | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
spack_foss-2022a_ppc | -1.501569625149231e-02 | -5.981999576231203e-05 | -5.981999576231203e-01 | PASS |
spack_foss-2022a_mpi_min | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] | -1.501569625151648e-02 | -5.981999578648020e-05 | -5.981999578648020e-01 | PASS |
cmake_foss_2022a_full_mpi | -1.501569625168566e-02 | -5.981999595565911e-05 | -5.981999595565910e-01 | PASS |
spack_foss-2022a_mpi | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
cmake_foss_2022a_min_serial | -1.501569625161315e-02 | -5.981999588315461e-05 | -5.981999588315460e-01 | PASS |
spack_foss-2023a_mpi | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
cmake_foss_2022a_min_mpi | -1.501569625178233e-02 | -5.981999605233351e-05 | -5.981999605233351e-01 | PASS |
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | -1.501569625168566e-02 | -5.981999595565911e-05 | -5.981999595565910e-01 | PASS |
GCI_foss-cmake: [foss2022a-serial, foss-min] | -1.501569625161315e-02 | -5.981999588315461e-05 | -5.981999588315460e-01 | PASS |
GCI_foss_opt_autotools: [foss2023a-serial] | -1.501569625161315e-02 | -5.981999588315461e-05 | -5.981999588315460e-01 | PASS |
GCI_foss-cmake: [foss2022a-serial, foss-full] | -1.501569625161315e-02 | -5.981999588315461e-05 | -5.981999588315460e-01 | PASS |
GCI_intel_autotools: [intel2023a-serial] | -1.501569625173400e-02 | -5.981999600399718e-05 | -5.981999600399718e-01 | PASS |
GCI_foss_omp_autotools: [foss2023a-serial] | -1.501569625166149e-02 | -5.981999593149094e-05 | -5.981999593149093e-01 | PASS |
GCI_intel_omp_autotools: [intel2023a-serial] | -1.501569625158898e-02 | -5.981999585898470e-05 | -5.981999585898470e-01 | PASS |
GCI_intel_omp_autotools: [intel2022a-serial] | -1.501569625158898e-02 | -5.981999585898470e-05 | -5.981999585898470e-01 | PASS |
GCI_intel_mpi_autotools: [intel2023a-mpi] | -1.501569625178233e-02 | -5.981999605233351e-05 | -5.981999605233351e-01 | PASS |
spack_foss-2023a_mpi_debug | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_ppc_autotools: [foss2022a-serial] | -1.501569625149231e-02 | -5.981999576231203e-05 | -5.981999576231203e-01 | PASS |
GCI_foss_min_autotools: [foss2022a-serial] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_min_autotools: [foss2023a-serial] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
spack_foss-2023a_mpi_min | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_min_autotools: [foss2023b-serial] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_autotools: [foss2022a-serial] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_autotools: [foss2023a-serial] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_autotools: [foss2023b-serial] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_debug_autotools: [foss2023a-serial] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
spack_foss-2023a_serial | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_mpi_min_autotools: [foss2022a-mpi] | -1.501569625173400e-02 | -5.981999600399718e-05 | -5.981999600399718e-01 | PASS |
GCI_foss_mpi_min_autotools: [foss2023a-mpi] | -1.501569625173400e-02 | -5.981999600399718e-05 | -5.981999600399718e-01 | PASS |
GCI_foss_mpi_autotools: [foss2022a-mpi] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_mpi_autotools: [foss2023a-mpi] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | -1.501569625168566e-02 | -5.981999595565911e-05 | -5.981999595565910e-01 | PASS |
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
spack_foss-2023a_mpi_opt | -1.501569625168566e-02 | -5.981999595565911e-05 | -5.981999595565910e-01 | PASS |
spack_foss-2023a_serial_debug | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
spack_foss-2023a_serial_min | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
spack_foss-2023a_serial_opt | -1.501569625161315e-02 | -5.981999588315461e-05 | -5.981999588315460e-01 | PASS |
spack_foss-2023a_mpi_omp | -1.501569625168566e-02 | -5.981999595565911e-05 | -5.981999595565910e-01 | PASS |
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | -1.501569625166149e-02 | -5.981999593149094e-05 | -5.981999593149093e-01 | PASS |
spack_foss-2023b_serial | -1.501569625170983e-02 | -5.981999597982901e-05 | -5.981999597982901e-01 | PASS |
spack_foss-2023a_serial_omp | -1.501569625166149e-02 | -5.981999593149094e-05 | -5.981999593149093e-01 | PASS |
spack_intel-2023a_serial | -1.501569625173400e-02 | -5.981999600399718e-05 | -5.981999600399718e-01 | PASS |
spack_intel-2022a_serial_omp | -1.501569625158898e-02 | -5.981999585898470e-05 | -5.981999585898470e-01 | PASS |
spack_intel-2023a_serial_omp | -1.501569625158898e-02 | -5.981999585898470e-05 | -5.981999585898470e-01 | PASS |
spack_intel-2023a_impi | -1.501569625178233e-02 | -5.981999605233351e-05 | -5.981999605233351e-01 | PASS |
spack_intel-2022a_impi_omp | -1.501569625166149e-02 | -5.981999593149094e-05 | -5.981999593149093e-01 | PASS |
spack_foss-2022a_cuda_mpi_omp | -1.501569625144397e-02 | -5.981999571397396e-05 | -5.981999571397396e-01 | PASS |
spack_foss-2022a_cuda_serial | -1.501569625151648e-02 | -5.981999578648020e-05 | -5.981999578648020e-01 | PASS |
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | -1.501569625178233e-02 | -5.981999605233351e-05 | -5.981999605233351e-01 | PASS |
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | -1.501569625168566e-02 | -5.981999595565911e-05 | -5.981999595565910e-01 | PASS |