Input 09-angular_momentum.02-td_gipaw.inp
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run foss_omp_autotools: [foss2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -2.319596313589528e+01 | -2.319596313589528e+01 | 2.320000000000000e-13 | 0.000000000000000e+00 | PASS |
| Energy [step 25] | -2.306769742316826e+01 | -2.306769742316820e+01 | 1.150000000000000e-12 | -6.039613253960852e-14 | PASS |
| Energy [step 50] | -2.306775467908152e+01 | -2.306775467908149e+01 | 2.310000000000000e-13 | -2.842170943040401e-14 | PASS |
| Energy [step 75] | -2.306781599435057e+01 | -2.306781599435064e+01 | 2.310000000000000e-13 | 7.460698725481052e-14 | PASS |
| Energy [step 100] | -2.306787047825558e+01 | -2.306787047825554e+01 | 2.310000000000000e-13 | -4.263256414560601e-14 | PASS |
| Lx [step 1] | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Lx [step 25] | 4.379017615444798e-02 | 4.379017615445080e-02 | 3.120000000000000e-15 | -2.817190924986335e-15 | PASS |
| Lx [step 50] | 7.224678178816247e-03 | 7.224678178820666e-03 | 5.270000000000000e-15 | -4.419208055050916e-15 | PASS |
| Lx [step 75] | -1.948226432550288e-02 | -1.948226432550024e-02 | 4.810000000000000e-15 | -2.636779683484747e-15 | PASS |
| Lx [step 100] | -3.047277365035547e-02 | -3.047277365035465e-02 | 5.470000000000000e-15 | -8.118505867571457e-16 | PASS |
| Ly [step 1] | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-14 | 0.000000000000000e+00 | PASS |
| Ly [step 25] | -7.184675044896745e-02 | -7.184675044896897e-02 | 3.880000000000000e-15 | 1.526556658859590e-15 | PASS |
| Ly [step 50] | -7.123184761552000e-03 | -7.123184761548256e-03 | 6.950000000000000e-15 | -3.743533261157950e-15 | PASS |
| Ly [step 75] | -4.172386570338810e-02 | -4.172386570338878e-02 | 2.890000000000000e-15 | 6.869504964868156e-16 | PASS |
| Ly [step 100] | -5.777037007126932e-02 | -5.777037007126750e-02 | 4.070000000000000e-15 | -1.817990202823694e-15 | PASS |
| Lz [step 1] | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Lz [step 25] | -9.755996688406052e-02 | -9.755996688406000e-02 | 4.140000000000000e-15 | -5.134781488891349e-16 | PASS |
| Lz [step 50] | 7.711998558583427e-03 | 7.711998558587046e-03 | 4.580000000000000e-15 | -3.618633170887620e-15 | PASS |
| Lz [step 75] | 7.208133272378722e-02 | 7.208133272378753e-02 | 5.780000000000000e-15 | -3.053113317719180e-16 | PASS |
| Lz [step 100] | 5.119788868443322e-02 | 5.119788868443480e-02 | 5.660000000000000e-15 | -1.582067810090848e-15 | PASS |
| Q(-2)[step 1] | -4.545137226010286e+00 | -4.545137226010302e+00 | 4.550000000000000e-14 | 1.598721155460225e-14 | PASS |
| Q(-2)[step 25] | -4.611689082743388e+00 | -4.611689082743363e+00 | 4.610000000000000e-14 | -2.486899575160351e-14 | PASS |
| Q(-2)[step 50] | -4.687399395140325e+00 | -4.687399395140323e+00 | 4.690000000000000e-14 | -1.776356839400250e-15 | PASS |
| Q(-2)[step 75] | -4.392452874733491e+00 | -4.392452874733464e+00 | 4.390000000000000e-14 | -2.664535259100376e-14 | PASS |
| Q(-2)[step 100] | -4.181650789981191e+00 | -4.181650789981192e+00 | 4.180000000000000e-14 | 8.881784197001252e-16 | PASS |
| Q(-1)[step 1] | 4.178376526406826e+00 | 4.178376526406848e+00 | 4.180000000000000e-14 | -2.220446049250313e-14 | PASS |
| Q(-1)[step 25] | 4.182321921047389e+00 | 4.182321921047410e+00 | 4.180000000000000e-14 | -2.131628207280301e-14 | PASS |
| Q(-1)[step 50] | 4.130858295004420e+00 | 4.130858295004428e+00 | 4.130000000000000e-14 | -7.993605777301127e-15 | PASS |
| Q(-1)[step 75] | 4.065033999154390e+00 | 4.065033999154396e+00 | 4.070000000000000e-14 | -6.217248937900877e-15 | PASS |
| Q(-1)[step 100] | 4.091905436315852e+00 | 4.091905436315860e+00 | 4.090000000000000e-14 | -8.881784197001252e-15 | PASS |
| Q( 0)[step 1] | -7.137538508704746e+00 | -7.137538508704713e+00 | 7.140000000000000e-14 | -3.286260152890463e-14 | PASS |
| Q( 0)[step 25] | -7.469859499746021e+00 | -7.469859499745980e+00 | 3.730000000000000e-13 | -4.085620730620576e-14 | PASS |
| Q( 0)[step 50] | -7.808672080156410e+00 | -7.808672080156406e+00 | 7.810000000000000e-14 | -4.440892098500626e-15 | PASS |
| Q( 0)[step 75] | -7.739383133589474e+00 | -7.739383133589480e+00 | 3.870000000000000e-13 | 6.217248937900877e-15 | PASS |
| Q( 0)[step 100] | -7.647990218749554e+00 | -7.647990218749506e+00 | 7.650000000000000e-14 | -4.796163466380676e-14 | PASS |
| Q( 1)[step 1] | -4.826117423972639e+00 | -4.826117423972624e+00 | 4.830000000000000e-14 | -1.509903313490213e-14 | PASS |
| Q( 1)[step 25] | -4.732913099704423e+00 | -4.732913099704414e+00 | 4.730000000000000e-14 | -9.769962616701378e-15 | PASS |
| Q( 1)[step 50] | -4.489483009608310e+00 | -4.489483009608300e+00 | 4.490000000000000e-14 | -1.065814103640150e-14 | PASS |
| Q( 1)[step 75] | -4.327506323667966e+00 | -4.327506323667949e+00 | 4.330000000000000e-14 | -1.687538997430238e-14 | PASS |
| Q( 1)[step 100] | -4.287562363821922e+00 | -4.287562363821902e+00 | 4.290000000000000e-14 | -2.042810365310288e-14 | PASS |
| Q( 2)[step 1] | 1.189093313558008e+01 | 1.189093313558002e+01 | 1.190000000000000e-13 | 5.506706202140776e-14 | PASS |
| Q( 2)[step 25] | 1.233960558678197e+01 | 1.233960558678198e+01 | 1.230000000000000e-13 | -1.421085471520200e-14 | PASS |
| Q( 2)[step 50] | 1.278020775793098e+01 | 1.278020775793098e+01 | 1.280000000000000e-13 | -3.552713678800501e-15 | PASS |
| Q( 2)[step 75] | 1.272940168424052e+01 | 1.272940168424052e+01 | 1.270000000000000e-13 | 0.000000000000000e+00 | PASS |
| Q( 2)[step 100] | 1.255123999562228e+01 | 1.255123999562224e+01 | 1.260000000000000e-13 | 3.552713678800501e-14 | PASS |