Input 09-angular_momentum.02-td_gipaw.inp
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run autotools_intel_mpi_omp: [intel2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -2.319596313589530e+01 | -2.319596313589528e+01 | 2.320000000000000e-13 | -2.486899575160351e-14 | PASS |
| Energy [step 25] | -2.306769742300160e+01 | -2.306769742300152e+01 | 2.310000000000000e-13 | -8.526512829121202e-14 | PASS |
| Energy [step 50] | -2.306775467891825e+01 | -2.306775467891822e+01 | 2.310000000000000e-13 | -2.486899575160351e-14 | PASS |
| Energy [step 75] | -2.306781599419043e+01 | -2.306781599419036e+01 | 2.310000000000000e-13 | -6.394884621840902e-14 | PASS |
| Energy [step 100] | -2.306787047809819e+01 | -2.306787047809808e+01 | 2.310000000000000e-13 | -1.101341240428155e-13 | PASS |
| Lx [step 1] | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Lx [step 25] | 4.379020381176279e-02 | 4.379020381176082e-02 | 3.240000000000000e-15 | 1.963706974805746e-15 | PASS |
| Lx [step 50] | 7.224735351252967e-03 | 7.224735351252857e-03 | 5.220000000000000e-15 | 1.101549407245273e-16 | PASS |
| Lx [step 75] | -1.948219859188541e-02 | -1.948219859188698e-02 | 5.000000000000000e-15 | 1.571659469234987e-15 | PASS |
| Lx [step 100] | -3.047272914508793e-02 | -3.047272914508759e-02 | 4.720000000000000e-15 | -3.400058012914542e-16 | PASS |
| Ly [step 1] | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-14 | 0.000000000000000e+00 | PASS |
| Ly [step 25] | -7.184679143626743e-02 | -7.184679143626962e-02 | 1.000000000000000e-14 | 2.192690473634684e-15 | PASS |
| Ly [step 50] | -7.123199186355456e-03 | -7.123199186356521e-03 | 1.000000000000000e-14 | 1.065120214249760e-15 | PASS |
| Ly [step 75] | -4.172388260206934e-02 | -4.172388260206918e-02 | 1.000000000000000e-14 | -1.595945597898663e-16 | PASS |
| Ly [step 100] | -5.777039641925273e-02 | -5.777039641925555e-02 | 1.000000000000000e-14 | 2.817190924986335e-15 | PASS |
| Lz [step 1] | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Lz [step 25] | -9.756003875547049e-02 | -9.756003875546621e-02 | 5.380000000000000e-15 | -4.288236432614667e-15 | PASS |
| Lz [step 50] | 7.711963005751749e-03 | 7.711963005751169e-03 | 3.770000000000000e-15 | 5.793976409762536e-16 | PASS |
| Lz [step 75] | 7.208133915095705e-02 | 7.208133915095838e-02 | 4.980000000000000e-15 | -1.332267629550188e-15 | PASS |
| Lz [step 100] | 5.119795103139001e-02 | 5.119795103139421e-02 | 6.180000000000000e-15 | -4.198030811863873e-15 | PASS |
| Q(-2)[step 1] | -4.545137052199744e+00 | -4.545137052199738e+00 | 4.550000000000000e-14 | -5.329070518200751e-15 | PASS |
| Q(-2)[step 25] | -4.611689024889100e+00 | -4.611689024889114e+00 | 4.610000000000000e-14 | 1.421085471520200e-14 | PASS |
| Q(-2)[step 50] | -4.687399335170611e+00 | -4.687399335170606e+00 | 4.690000000000000e-14 | -5.329070518200751e-15 | PASS |
| Q(-2)[step 75] | -4.392452781162867e+00 | -4.392452781162872e+00 | 4.390000000000000e-14 | 4.440892098500626e-15 | PASS |
| Q(-2)[step 100] | -4.181650669192829e+00 | -4.181650669192826e+00 | 4.180000000000000e-14 | -3.552713678800501e-15 | PASS |
| Q(-1)[step 1] | 4.178376177672455e+00 | 4.178376177672466e+00 | 4.180000000000000e-14 | -1.154631945610163e-14 | PASS |
| Q(-1)[step 25] | 4.182321698162382e+00 | 4.182321698162409e+00 | 4.180000000000000e-14 | -2.664535259100376e-14 | PASS |
| Q(-1)[step 50] | 4.130858161889451e+00 | 4.130858161889484e+00 | 4.130000000000000e-14 | -3.286260152890463e-14 | PASS |
| Q(-1)[step 75] | 4.065033937225654e+00 | 4.065033937225686e+00 | 5.570000000000000e-14 | -3.197442310920451e-14 | PASS |
| Q(-1)[step 100] | 4.091905451310800e+00 | 4.091905451310831e+00 | 4.930000000000000e-14 | -3.108624468950438e-14 | PASS |
| Q( 0)[step 1] | -7.137538347499722e+00 | -7.137538347499744e+00 | 7.140000000000000e-14 | 2.131628207280301e-14 | PASS |
| Q( 0)[step 25] | -7.469859326094126e+00 | -7.469859326094152e+00 | 7.470000000000000e-14 | 2.664535259100376e-14 | PASS |
| Q( 0)[step 50] | -7.808671887849111e+00 | -7.808671887849136e+00 | 7.810000000000000e-14 | 2.486899575160351e-14 | PASS |
| Q( 0)[step 75] | -7.739382942403838e+00 | -7.739382942403811e+00 | 7.740000000000000e-14 | -2.664535259100376e-14 | PASS |
| Q( 0)[step 100] | -7.647990088222083e+00 | -7.647990088222071e+00 | 7.650000000000000e-14 | -1.154631945610163e-14 | PASS |
| Q( 1)[step 1] | -4.826117320427217e+00 | -4.826117320427213e+00 | 4.830000000000000e-14 | -4.440892098500626e-15 | PASS |
| Q( 1)[step 25] | -4.732913015579485e+00 | -4.732913015579491e+00 | 4.730000000000000e-14 | 5.329070518200751e-15 | PASS |
| Q( 1)[step 50] | -4.489482808607193e+00 | -4.489482808607196e+00 | 4.490000000000000e-14 | 3.552713678800501e-15 | PASS |
| Q( 1)[step 75] | -4.327506057884670e+00 | -4.327506057884650e+00 | 2.160000000000000e-13 | -1.953992523340276e-14 | PASS |
| Q( 1)[step 100] | -4.287562118473191e+00 | -4.287562118473162e+00 | 4.290000000000000e-14 | -2.842170943040401e-14 | PASS |
| Q( 2)[step 1] | 1.189093351652640e+01 | 1.189093351652641e+01 | 1.190000000000000e-13 | -1.065814103640150e-14 | PASS |
| Q( 2)[step 25] | 1.233960581602611e+01 | 1.233960581602611e+01 | 1.230000000000000e-13 | -1.776356839400250e-15 | PASS |
| Q( 2)[step 50] | 1.278020792727980e+01 | 1.278020792727984e+01 | 1.280000000000000e-13 | -4.440892098500626e-14 | PASS |
| Q( 2)[step 75] | 1.272940184332368e+01 | 1.272940184332372e+01 | 1.270000000000000e-13 | -4.263256414560601e-14 | PASS |
| Q( 2)[step 100] | 1.255124012540238e+01 | 1.255124012540242e+01 | 1.260000000000000e-13 | -4.085620730620576e-14 | PASS |