Match comparison for Correlation energy (match type 28512)
General information
| Reference |
Precision |
Mean |
Standard deviation |
Midpoint |
Half width |
Status |
| -2.036583820000000e+00 |
1.020000000000000e-07 |
-2.036583833478260e+00 |
1.991475212041841e-08 |
-2.036583865000000e+00 |
5.499999988778370e-08 |
PASS |
Checks for this match
- GPU builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
Detailed information
Reference: -2.03658382, precision: 0.000000102
| Run |
Value |
Difference |
Relative difference |
Status |
| foss-2022a_ppc |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| cmake_foss_2022a_full_serial |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| cmake_foss_2022a_min_serial |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| cmake_foss_2022a_full_mpi |
-2.036583810000000e+00 |
9.999999939225290e-09 |
9.803921509044403e-02 |
PASS |
| cmake_foss_2022a_min_mpi |
-2.036583810000000e+00 |
9.999999939225290e-09 |
9.803921509044403e-02 |
PASS |
| eb_foss-2022a |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| eb_fosscuda-2022a |
-2.036583920000000e+00 |
-9.999999983634211e-08 |
-9.803921552582560e-01 |
PASS |
| eb_foss-2022a_debug |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| eb_foss-2022b_libxc6 |
-2.036583840000000e+00 |
-1.999999987845058e-08 |
-1.960784301808881e-01 |
PASS |
| eb_foss-2022a_mpi |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| foss-2022a_opt |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| eb_fosscuda-2022a_mpi_omp |
-2.036583840000000e+00 |
-1.999999987845058e-08 |
-1.960784301808881e-01 |
PASS |
| intel-2022a |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| eb_foss-2022b_libxc6_mpi |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| foss-2022a_omp |
-2.036583820000000e+00 |
0.000000000000000e+00 |
0.000000000000000e+00 |
PASS |
| intel-2022b |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| eb_foss-2022a_mpi_debug |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| intel-2022a_omp |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| intel-2022a_impi |
-2.036583840000000e+00 |
-1.999999987845058e-08 |
-1.960784301808881e-01 |
PASS |
| spack_foss-2022a_serial |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| intel-2022b_impi |
-2.036583840000000e+00 |
-1.999999987845058e-08 |
-1.960784301808881e-01 |
PASS |
| foss-2022a_mpi_omp |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |
| spack_foss-2022a_serial_min |
-2.036583830000000e+00 |
-9.999999939225290e-09 |
-9.803921509044403e-02 |
PASS |