Match comparison for Energy [step 20] (match type 12072)

Commits > Commit 15b914f6cf8a906b04634cf1151edac44a3f54fa > Input 14-fullerene_unpacked.02-td-unpacked.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184088237668212e+02 1.100000000000000e-10 -3.184088237668681e+02 7.218329965520277e-11 -3.184088237668212e+02 8.810729923425242e-11 PASS
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Detailed information

Reference: -318.40882376682123, precision: 0.00000000011
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -3.184088237669067e+02 -8.543565854779445e-11 -7.766878049799496e-01 PASS
spack_foss-2022a_serial_min -3.184088237667331e+02 8.810729923425242e-11 8.009754475841130e-01 PASS
spack_foss-2023a_serial_min -3.184088237667331e+02 8.810729923425242e-11 8.009754475841130e-01 PASS
spack_foss-2023a_serial -3.184088237667331e+02 8.810729923425242e-11 8.009754475841130e-01 PASS
spack_foss-2022a_serial -3.184088237667331e+02 8.810729923425242e-11 8.009754475841130e-01 PASS
spack_foss-2022a_ppc -3.184088237669055e+02 -8.429879017057829e-11 -7.663526379143480e-01 PASS
cmake_foss_2022a_min_serial -3.184088237669067e+02 -8.543565854779445e-11 -7.766878049799496e-01 PASS
cmake_foss_2022a_min_mpi -3.184088237669081e+02 -8.685674401931465e-11 -7.896067638119514e-01 PASS
spack_foss-2023a_mpi_min -3.184088237669090e+02 -8.776623872108757e-11 -7.978748974644325e-01 PASS
spack_foss-2022a_mpi_min -3.184088237669090e+02 -8.776623872108757e-11 -7.978748974644325e-01 PASS
cmake_foss_2022a_full_mpi -3.184088237669060e+02 -8.481038094032556e-11 -7.710034630938687e-01 PASS
spack_foss-2023a_serial_debug -3.184088237667331e+02 8.810729923425242e-11 8.009754475841130e-01 PASS
spack_foss-2023a_mpi_opt -3.184088237669081e+02 -8.691358743817545e-11 -7.901235221652314e-01 PASS
spack_foss-2022a_mpi -3.184088237669057e+02 -8.446932042716071e-11 -7.679029129741883e-01 PASS
spack_foss-2023a_mpi -3.184088237669093e+02 -8.810729923425242e-11 -8.009754475841130e-01 PASS
spack_foss-2022a_cuda_serial -3.184088237669064e+02 -8.520828487235121e-11 -7.746207715668293e-01 PASS
spack_foss-2022a_cuda_mpi_omp -3.184088237669063e+02 -8.503775461576879e-11 -7.730704965069890e-01 PASS
spack_foss-2023a_mpi_debug -3.184088237669054e+02 -8.412825991399586e-11 -7.648023628545079e-01 PASS
spack_foss-2023a_mpi_omp -3.184088237669074e+02 -8.617462299298495e-11 -7.834056635725904e-01 PASS
spack_foss-2023a_serial_opt -3.184088237669067e+02 -8.543565854779445e-11 -7.766878049799496e-01 PASS
spack_foss-2023b_serial -3.184088237667331e+02 8.810729923425242e-11 8.009754475841130e-01 PASS
spack_foss-2023a_serial_omp -3.184088237669073e+02 -8.606093615526333e-11 -7.823721468660304e-01 PASS
spack_intel-2023a_serial -3.184088237668998e+02 -7.861444828449748e-11 -7.146768025863408e-01 PASS
spack_intel-2022a_serial_omp -3.184088237669079e+02 -8.662937034387141e-11 -7.875397303988311e-01 PASS
spack_intel-2023a_serial_omp -3.184088237669043e+02 -8.310507837450132e-11 -7.555007124954666e-01 PASS
spack_intel-2023a_impi -3.184088237669089e+02 -8.770939530222677e-11 -7.973581391111525e-01 PASS
spack_intel-2022a_impi_omp -3.184088237669060e+02 -8.481038094032556e-11 -7.710034630938687e-01 PASS