Match comparison for gga_x_mpw91 Int[n*v_xc] (match type 12333)
General information
| Reference |
Precision |
Mean |
Standard deviation |
Midpoint |
Half width |
Status |
| -4.065063800000000e-01 |
4.890000000000000e-06 |
-4.065100473913044e-01 |
2.508207774119482e-06 |
-4.065063750000000e-01 |
4.464999999981289e-06 |
PASS |
Checks for this match
- GPU builders have different values.
Detailed information
Reference: -0.40650638, precision: 0.00000489
| Run |
Value |
Difference |
Relative difference |
Status |
| foss-2022a_ppc |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| cmake_foss_2022a_full_serial |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| cmake_foss_2022a_min_serial |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| cmake_foss_2022a_full_mpi |
-4.065108400000000e-01 |
-4.459999999983921e-06 |
-9.120654396695136e-01 |
PASS |
| cmake_foss_2022a_min_mpi |
-4.065108400000000e-01 |
-4.459999999983921e-06 |
-9.120654396695136e-01 |
PASS |
| eb_foss-2022a |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| eb_fosscuda-2022a |
-4.065019100000000e-01 |
4.469999999978658e-06 |
9.141104294434883e-01 |
PASS |
| eb_foss-2022a_debug |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| eb_foss-2022b_libxc6 |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| eb_foss-2022a_mpi |
-4.065108400000000e-01 |
-4.459999999983921e-06 |
-9.120654396695136e-01 |
PASS |
| foss-2022a_opt |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| eb_fosscuda-2022a_mpi_omp |
-4.065019300000000e-01 |
4.449999999989185e-06 |
9.100204498955389e-01 |
PASS |
| intel-2022a |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| eb_foss-2022b_libxc6_mpi |
-4.065108400000000e-01 |
-4.459999999983921e-06 |
-9.120654396695136e-01 |
PASS |
| foss-2022a_omp |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| intel-2022b |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| eb_foss-2022a_mpi_debug |
-4.065108400000000e-01 |
-4.459999999983921e-06 |
-9.120654396695136e-01 |
PASS |
| intel-2022a_omp |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| intel-2022a_impi |
-4.065108400000000e-01 |
-4.459999999983921e-06 |
-9.120654396695136e-01 |
PASS |
| spack_foss-2022a_serial |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |
| intel-2022b_impi |
-4.065108400000000e-01 |
-4.459999999983921e-06 |
-9.120654396695136e-01 |
PASS |
| foss-2022a_mpi_omp |
-4.065108400000000e-01 |
-4.459999999983921e-06 |
-9.120654396695136e-01 |
PASS |
| spack_foss-2022a_serial_min |
-4.065108100000000e-01 |
-4.429999999999712e-06 |
-9.059304703475894e-01 |
PASS |