Match comparison for X Coordinate Atom 1 [step 30] (match type 14060)

Commits > Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 > Input 19-td_move_ions.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.649896980829332e-01 2.650000000000000e-15 -2.649896980829333e-01 0.000000000000000e+00 -2.649896980829333e-01 0.000000000000000e+00 PASS
Checks do not indicate problems with this match.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -0.2649896980829332, precision: 0.00000000000000265
Run Value Difference Relative difference Status
spack_foss-2023a_serial_min -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023a_serial_opt -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2022a_serial -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2022a_serial_min -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2022a_ppc -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023a_serial -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023b_serial -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2022a_mpi_min -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023a_mpi_min -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023a_serial_omp -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023a_mpi_opt -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2022a_mpi -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023a_mpi -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023a_serial_debug -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023a_mpi_debug -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_min_autotools: [foss2022a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_min_autotools: [foss2023a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_min_autotools: [foss2023b-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_autotools: [foss2022a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_autotools: [foss2023b-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_autotools: [foss2023a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2023a_mpi_omp -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
cmake_foss_2022a_full_serial -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
cmake_foss_2022a_min_serial -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
cmake_foss_2022a_min_mpi -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
cmake_foss_2022a_full_mpi -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_intel-2022a_impi_omp -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_intel-2023a_serial -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_intel-2022a_serial_omp -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_intel-2023a_serial_omp -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_intel-2023a_impi -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2022a_cuda_mpi_omp -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
spack_foss-2022a_cuda_serial -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -2.649896980829333e-01 -5.551115123125783e-17 -2.094760423821050e-02 PASS