Match comparison for Force C2 (z) (match type 24684)
Commits >
Commit dfb998a08bfe04488932b5e2d20d2b9995cc9a79 >
Input 12-vdw_solid_c6.02-gs_graphene.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 2.622699800000000e-15 | 6.310000000000000e-15 | 1.295905376886207e-15 | 1.294696826318641e-15 | 8.364884000000000e-16 | 2.508137830000000e-15 | PASS |
Checks for this match
- Precision seems large and value close to zero. Should value be 0?
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 0.0000000000000026226998, precision: 0.00000000000000631| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | 2.513324400000000e-15 | -1.093753999999999e-16 | -1.733366085578444e-02 | PASS |
| cmake_foss_2022a_full_serial | 1.102481810000000e-15 | -1.520217990000000e-15 | -2.409220269413629e-01 | PASS |
| foss-2022a_opt | 2.622685920000000e-15 | -1.387999999986761e-20 | -2.199683042768242e-06 | PASS |
| intel-2022a | 3.344626230000000e-15 | 7.219264300000001e-16 | 1.144098938193344e-01 | PASS |
| cmake_foss_2022a_full_mpi | 1.835082830000000e-16 | -2.439191517000000e-15 | -3.865596698890649e-01 | PASS |
| cmake_foss_2022a_min_serial | 1.102481810000000e-15 | -1.520217990000000e-15 | -2.409220269413629e-01 | PASS |
| foss-2022a_omp | 3.123212390000000e-16 | -2.310378561000000e-15 | -3.661455722662440e-01 | PASS |
| cmake_foss_2022a_min_mpi | 1.835082830000000e-16 | -2.439191517000000e-15 | -3.865596698890649e-01 | PASS |
| eb_fosscuda-2022a | -1.671649430000000e-15 | -4.294349229999999e-15 | -6.805624770206021e-01 | PASS |
| intel-2022a_impi | 2.608844450000000e-15 | -1.385534999999984e-17 | -2.195776545166378e-03 | PASS |
| eb_foss-2022a | 2.622685920000000e-15 | -1.387999999986761e-20 | -2.199683042768242e-06 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 4.686490860000000e-16 | -2.154050714000000e-15 | -3.413709530903328e-01 | PASS |
| eb_foss-2022a_debug | 2.622685920000000e-15 | -1.387999999986761e-20 | -2.199683042768242e-06 | PASS |
| eb_foss-2022b_libxc6 | -1.211443230000000e-15 | -3.834143030000000e-15 | -6.076296402535657e-01 | PASS |
| eb_foss-2022a_mpi | 2.623734370000000e-15 | 1.034570000000300e-18 | 1.639572107765927e-04 | PASS |
| foss-2022a_mpi_omp | 2.290975080000000e-15 | -3.317247199999997e-16 | -5.257127099841517e-02 | PASS |
| eb_foss-2022b_libxc6_mpi | -2.411889460000000e-16 | -2.863888746000000e-15 | -4.538650944532487e-01 | PASS |
| intel-2022b | 3.344626230000000e-15 | 7.219264300000001e-16 | 1.144098938193344e-01 | PASS |
| eb_foss-2022a_mpi_debug | 2.623734370000000e-15 | 1.034570000000300e-18 | 1.639572107765927e-04 | PASS |
| spack_foss-2022a_serial | 1.102481810000000e-15 | -1.520217990000000e-15 | -2.409220269413629e-01 | PASS |
| intel-2022a_omp | 5.110270070000000e-17 | -2.571597099300000e-15 | -4.075431219175911e-01 | PASS |
| spack_foss-2022a_mpi | 1.835082830000000e-16 | -2.439191517000000e-15 | -3.865596698890649e-01 | PASS |
| spack_foss-2022a_serial_debug | 1.102481810000000e-15 | -1.520217990000000e-15 | -2.409220269413629e-01 | PASS |
| spack_foss-2022a_serial_min | 1.102481810000000e-15 | -1.520217990000000e-15 | -2.409220269413629e-01 | PASS |
| intel-2022b_impi | 2.608844450000000e-15 | -1.385534999999984e-17 | -2.195776545166378e-03 | PASS |
| spack_foss-2022a_serial_omp | 1.319394560000000e-15 | -1.303305240000000e-15 | -2.065459968304278e-01 | PASS |
| spack_foss-2022a_serial_opt | 1.102481810000000e-15 | -1.520217990000000e-15 | -2.409220269413629e-01 | PASS |
| spack_foss-2022a_mpi_omp | 1.207797350000000e-15 | -1.414902450000000e-15 | -2.242317670364501e-01 | PASS |
| intel-2022a_omp_impi | 3.540895510000000e-16 | -2.268610249000000e-15 | -3.595261884310618e-01 | PASS |