Match comparison for gga_xc_b97_d Int[n*v_xc] (match type 12393)
General information
| Reference |
Precision |
Mean |
Standard deviation |
Midpoint |
Half width |
Status |
| -4.315265750000000e-01 |
5.350000000000000e-06 |
-4.315305856521739e-01 |
2.740667684572191e-06 |
-4.315265700000000e-01 |
4.879999999984896e-06 |
PASS |
Checks for this match
- GPU builders have different values.
Detailed information
Reference: -0.431526575, precision: 0.00000535
| Run |
Value |
Difference |
Relative difference |
Status |
| foss-2022a_ppc |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| cmake_foss_2022a_full_serial |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| cmake_foss_2022a_min_serial |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| cmake_foss_2022a_full_mpi |
-4.315314500000000e-01 |
-4.874999999959773e-06 |
-9.112149532635090e-01 |
PASS |
| cmake_foss_2022a_min_mpi |
-4.315314500000000e-01 |
-4.874999999959773e-06 |
-9.112149532635090e-01 |
PASS |
| eb_foss-2022a |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| eb_fosscuda-2022a |
-4.315216900000000e-01 |
4.885000000010020e-06 |
9.130841121514057e-01 |
PASS |
| eb_foss-2022a_debug |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| eb_foss-2022b_libxc6 |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| eb_foss-2022a_mpi |
-4.315314500000000e-01 |
-4.874999999959773e-06 |
-9.112149532635090e-01 |
PASS |
| foss-2022a_opt |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| eb_fosscuda-2022a_mpi_omp |
-4.315217200000000e-01 |
4.855000000025811e-06 |
9.074766355188433e-01 |
PASS |
| intel-2022a |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| eb_foss-2022b_libxc6_mpi |
-4.315314500000000e-01 |
-4.874999999959773e-06 |
-9.112149532635090e-01 |
PASS |
| foss-2022a_omp |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| intel-2022b |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| eb_foss-2022a_mpi_debug |
-4.315314500000000e-01 |
-4.874999999959773e-06 |
-9.112149532635090e-01 |
PASS |
| intel-2022a_omp |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| intel-2022a_impi |
-4.315314500000000e-01 |
-4.874999999959773e-06 |
-9.112149532635090e-01 |
PASS |
| spack_foss-2022a_serial |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |
| intel-2022b_impi |
-4.315314500000000e-01 |
-4.874999999959773e-06 |
-9.112149532635090e-01 |
PASS |
| foss-2022a_mpi_omp |
-4.315314500000000e-01 |
-4.874999999959773e-06 |
-9.112149532635090e-01 |
PASS |
| spack_foss-2022a_serial_min |
-4.315314200000000e-01 |
-4.844999999975563e-06 |
-9.056074766309464e-01 |
PASS |