Input 09-angular_momentum.02-td_gipaw.inp
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run intel_omp_autotools: [intel2022a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -2.319596313589531e+01 | -2.319596313589528e+01 | 2.320000000000000e-13 | -2.842170943040401e-14 | PASS |
| Energy [step 25] | -2.306769742300155e+01 | -2.306769742300152e+01 | 2.310000000000000e-13 | -3.197442310920451e-14 | PASS |
| Energy [step 50] | -2.306775467891821e+01 | -2.306775467891822e+01 | 2.310000000000000e-13 | 1.065814103640150e-14 | PASS |
| Energy [step 75] | -2.306781599419043e+01 | -2.306781599419036e+01 | 2.310000000000000e-13 | -7.105427357601002e-14 | PASS |
| Energy [step 100] | -2.306787047809818e+01 | -2.306787047809808e+01 | 2.310000000000000e-13 | -9.592326932761353e-14 | PASS |
| Lx [step 1] | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Lx [step 25] | 4.379020381176245e-02 | 4.379020381176082e-02 | 3.240000000000000e-15 | 1.623701173514291e-15 | PASS |
| Lx [step 50] | 7.224735351252740e-03 | 7.224735351252857e-03 | 5.220000000000000e-15 | -1.170938346284345e-16 | PASS |
| Lx [step 75] | -1.948219859188674e-02 | -1.948219859188698e-02 | 5.000000000000000e-15 | 2.428612866367530e-16 | PASS |
| Lx [step 100] | -3.047272914508520e-02 | -3.047272914508759e-02 | 4.720000000000000e-15 | 2.386979502944087e-15 | PASS |
| Ly [step 1] | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-14 | 0.000000000000000e+00 | PASS |
| Ly [step 25] | -7.184679143627389e-02 | -7.184679143626962e-02 | 1.000000000000000e-14 | -4.260480856999038e-15 | PASS |
| Ly [step 50] | -7.123199186357253e-03 | -7.123199186356521e-03 | 1.000000000000000e-14 | -7.320533068622126e-16 | PASS |
| Ly [step 75] | -4.172388260207110e-02 | -4.172388260206918e-02 | 1.000000000000000e-14 | -1.915134717478395e-15 | PASS |
| Ly [step 100] | -5.777039641925788e-02 | -5.777039641925555e-02 | 1.000000000000000e-14 | -2.331468351712829e-15 | PASS |
| Lz [step 1] | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Lz [step 25] | -9.756003875546956e-02 | -9.756003875546621e-02 | 5.380000000000000e-15 | -3.358424649491099e-15 | PASS |
| Lz [step 50] | 7.711963005748633e-03 | 7.711963005751169e-03 | 3.770000000000000e-15 | -2.536165721878092e-15 | PASS |
| Lz [step 75] | 7.208133915096053e-02 | 7.208133915095838e-02 | 4.980000000000000e-15 | 2.151057110211241e-15 | PASS |
| Lz [step 100] | 5.119795103139350e-02 | 5.119795103139421e-02 | 6.180000000000000e-15 | -7.147060721024445e-16 | PASS |
| Q(-2)[step 1] | -4.545137052199737e+00 | -4.545137052199738e+00 | 4.550000000000000e-14 | 8.881784197001252e-16 | PASS |
| Q(-2)[step 25] | -4.611689024889088e+00 | -4.611689024889114e+00 | 4.610000000000000e-14 | 2.575717417130363e-14 | PASS |
| Q(-2)[step 50] | -4.687399335170605e+00 | -4.687399335170606e+00 | 4.690000000000000e-14 | 8.881784197001252e-16 | PASS |
| Q(-2)[step 75] | -4.392452781162858e+00 | -4.392452781162872e+00 | 4.390000000000000e-14 | 1.421085471520200e-14 | PASS |
| Q(-2)[step 100] | -4.181650669192830e+00 | -4.181650669192826e+00 | 4.180000000000000e-14 | -4.440892098500626e-15 | PASS |
| Q(-1)[step 1] | 4.178376177672443e+00 | 4.178376177672466e+00 | 4.180000000000000e-14 | -2.309263891220326e-14 | PASS |
| Q(-1)[step 25] | 4.182321698162376e+00 | 4.182321698162409e+00 | 4.180000000000000e-14 | -3.286260152890463e-14 | PASS |
| Q(-1)[step 50] | 4.130858161889447e+00 | 4.130858161889484e+00 | 4.130000000000000e-14 | -3.730349362740526e-14 | PASS |
| Q(-1)[step 75] | 4.065033937225635e+00 | 4.065033937225686e+00 | 5.570000000000000e-14 | -5.062616992290714e-14 | PASS |
| Q(-1)[step 100] | 4.091905451310786e+00 | 4.091905451310831e+00 | 4.930000000000000e-14 | -4.529709940470639e-14 | PASS |
| Q( 0)[step 1] | -7.137538347499728e+00 | -7.137538347499744e+00 | 7.140000000000000e-14 | 1.598721155460225e-14 | PASS |
| Q( 0)[step 25] | -7.469859326094115e+00 | -7.469859326094152e+00 | 7.470000000000000e-14 | 3.730349362740526e-14 | PASS |
| Q( 0)[step 50] | -7.808671887849097e+00 | -7.808671887849136e+00 | 7.810000000000000e-14 | 3.907985046680551e-14 | PASS |
| Q( 0)[step 75] | -7.739382942403846e+00 | -7.739382942403811e+00 | 7.740000000000000e-14 | -3.463895836830488e-14 | PASS |
| Q( 0)[step 100] | -7.647990088222095e+00 | -7.647990088222071e+00 | 7.650000000000000e-14 | -2.398081733190338e-14 | PASS |
| Q( 1)[step 1] | -4.826117320427204e+00 | -4.826117320427213e+00 | 4.830000000000000e-14 | 8.881784197001252e-15 | PASS |
| Q( 1)[step 25] | -4.732913015579470e+00 | -4.732913015579491e+00 | 4.730000000000000e-14 | 2.042810365310288e-14 | PASS |
| Q( 1)[step 50] | -4.489482808607189e+00 | -4.489482808607196e+00 | 4.490000000000000e-14 | 7.105427357601002e-15 | PASS |
| Q( 1)[step 75] | -4.327506057884667e+00 | -4.327506057884650e+00 | 2.160000000000000e-13 | -1.687538997430238e-14 | PASS |
| Q( 1)[step 100] | -4.287562118473184e+00 | -4.287562118473162e+00 | 4.290000000000000e-14 | -2.220446049250313e-14 | PASS |
| Q( 2)[step 1] | 1.189093351652642e+01 | 1.189093351652641e+01 | 1.190000000000000e-13 | 1.421085471520200e-14 | PASS |
| Q( 2)[step 25] | 1.233960581602611e+01 | 1.233960581602611e+01 | 1.230000000000000e-13 | 5.329070518200751e-15 | PASS |
| Q( 2)[step 50] | 1.278020792727981e+01 | 1.278020792727984e+01 | 1.280000000000000e-13 | -3.375077994860476e-14 | PASS |
| Q( 2)[step 75] | 1.272940184332368e+01 | 1.272940184332372e+01 | 1.270000000000000e-13 | -4.440892098500626e-14 | PASS |
| Q( 2)[step 100] | 1.255124012540238e+01 | 1.255124012540242e+01 | 1.260000000000000e-13 | -3.730349362740526e-14 | PASS |