Match comparison for Ex (x= 0.76,y= 0,z=0) [step 400] (match type 24563)
Commits >
Commit 9c86d3f9e0672ab6f34186f0e6ca5b729d8f047e >
Input 12-tddft-currents-to-maxwell.06-benzene-dipole-and-quadrupole.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.434267262226580e-04 | 5.000000000000000e-07 | -3.434267262143400e-04 | 4.642314204557549e-16 | -3.434267262141850e-04 | 9.910149957603753e-16 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -0.000343426726222658, precision: 0.0000005| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -3.434267262139110e-04 | 8.747017866961304e-15 | 1.749403573392261e-08 | PASS |
| foss-2022a_ppc | -3.434267262131940e-04 | 9.464000763625968e-15 | 1.892800152725194e-08 | PASS |
| spack_foss-2022a_serial_min | -3.434267262139110e-04 | 8.747017866961304e-15 | 1.749403573392261e-08 | PASS |
| spack_foss-2022a_serial | -3.434267262139110e-04 | 8.747017866961304e-15 | 1.749403573392261e-08 | PASS |
| foss-2022a_opt | -3.434267262144860e-04 | 8.172011244783617e-15 | 1.634402248956723e-08 | PASS |
| cmake_foss_2022a_min_mpi | -3.434267262140140e-04 | 8.644018660575181e-15 | 1.728803732115036e-08 | PASS |
| intel-2022a | -3.434267262145980e-04 | 8.060013160365864e-15 | 1.612002632073173e-08 | PASS |
| cmake_foss_2022a_full_mpi | -3.434267262147450e-04 | 7.912995345776830e-15 | 1.582599069155366e-08 | PASS |
| spack_foss-2022a_serial_omp | -3.434267262142120e-04 | 8.445989133770704e-15 | 1.689197826754141e-08 | PASS |
| spack_foss-2022a_serial_debug | -3.434267262139110e-04 | 8.747017866961304e-15 | 1.749403573392261e-08 | PASS |
| foss-2022a_omp | -3.434267262150740e-04 | 7.583994196536104e-15 | 1.516798839307221e-08 | PASS |
| cmake_foss_2022a_min_serial | -3.434267262139110e-04 | 8.747017866961304e-15 | 1.749403573392261e-08 | PASS |
| eb_fosscuda-2022a | -3.434267262144540e-04 | 8.203995208871939e-15 | 1.640799041774388e-08 | PASS |
| intel-2022a_omp | -3.434267262143520e-04 | 8.306018633302825e-15 | 1.661203726660565e-08 | PASS |
| intel-2022b_impi | -3.434267262137670e-04 | 8.890999915467379e-15 | 1.778199983093476e-08 | PASS |
| intel-2022a_impi | -3.434267262137670e-04 | 8.890999915467379e-15 | 1.778199983093476e-08 | PASS |
| foss-2022a_mpi_omp | -3.434267262146700e-04 | 7.987967926004202e-15 | 1.597593585200840e-08 | PASS |
| eb_foss-2022a | -3.434267262144860e-04 | 8.172011244783617e-15 | 1.634402248956723e-08 | PASS |
| eb_foss-2022b_libxc6 | -3.434267262147100e-04 | 7.948015075948112e-15 | 1.589603015189622e-08 | PASS |
| eb_foss-2022a_debug | -3.434267262144860e-04 | 8.172011244783617e-15 | 1.634402248956723e-08 | PASS |
| intel-2022a_omp_impi | -3.434267262151760e-04 | 7.481970772105218e-15 | 1.496394154421044e-08 | PASS |
| eb_foss-2022a_mpi | -3.434267262143920e-04 | 8.266011573138110e-15 | 1.653202314627622e-08 | PASS |
| eb_foss-2022b_libxc6_mpi | -3.434267262151680e-04 | 7.489993868181610e-15 | 1.497998773636322e-08 | PASS |
| eb_foss-2022a_mpi_debug | -3.434267262143920e-04 | 8.266011573138110e-15 | 1.653202314627622e-08 | PASS |
| intel-2022b | -3.434267262145980e-04 | 8.060013160365864e-15 | 1.612002632073173e-08 | PASS |
| eb_fosscuda-2022a_mpi_omp | -3.434267262145440e-04 | 8.114006428555642e-15 | 1.622801285711128e-08 | PASS |