Input 06-h2o_pol_lr.02_kdotp.inp
Commits >
Commit a41c007d955b10e3b7368ff6ffc60ddf6399c944 >
Run foss_mpi_opt_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Inverse effective mass 1 | 1.533000000000000e-03 | 1.533000000000000e-03 | 7.660000000000000e-06 | 2.168404344971009e-19 | PASS |
| Inverse effective mass 2 | 1.355400000000000e-02 | 1.355400000000000e-02 | 6.780000000000000e-06 | 0.000000000000000e+00 | PASS |
| Inverse effective mass 3 | 1.659500000000000e-02 | 1.659500000000000e-02 | 8.300000000000000e-06 | 0.000000000000000e+00 | PASS |
| Inverse effective mass 4 | 2.047400000000000e-02 | 2.047400000000000e-02 | 2.050000000000000e-16 | -3.469446951953614e-18 | PASS |