Input 09-angular_momentum.02-td_gipaw.inp

Commits > Commit 16a288d93f4684890591c6dab8ffeadb82c84e9a > Run intel_mpi_omp_autotools: [intel2022a-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
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