Input 09-angular_momentum.02-td_gipaw.inp

Commits > Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 > Run cuda-serial: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -2.319596313589526e+01 -2.319596313589528e+01 2.320000000000000e-13 2.131628207280301e-14 PASS
Energy [step 25] -2.306769742316810e+01 -2.306769742316820e+01 1.150000000000000e-12 1.030286966852145e-13 PASS
Energy [step 50] -2.306775467908139e+01 -2.306775467908149e+01 2.310000000000000e-13 1.030286966852145e-13 PASS
Energy [step 75] -2.306781599435057e+01 -2.306781599435064e+01 2.310000000000000e-13 7.105427357601002e-14 PASS
Energy [step 100] -2.306787047825544e+01 -2.306787047825554e+01 2.310000000000000e-13 9.947598300641403e-14 PASS
Lx [step 1] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Lx [step 25] 4.379017615445092e-02 4.379017615445038e-02 3.610000000000000e-15 5.481726184086710e-16 PASS
Lx [step 50] 7.224678178817034e-03 7.224678178819371e-03 6.700000000000000e-15 -2.336672522140759e-15 PASS
Lx [step 75] -1.948226432550056e-02 -1.948226432550091e-02 5.550000000000000e-15 3.504141421473150e-16 PASS
Lx [step 100] -3.047277365035964e-02 -3.047277365035511e-02 7.000000000000000e+00 -4.531097719251420e-15 PASS
Ly [step 1] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-14 0.000000000000000e+00 PASS
Ly [step 25] -7.184675044896821e-02 -7.184675044896897e-02 3.880000000000000e-15 7.632783294297951e-16 PASS
Ly [step 50] -7.123184761547205e-03 -7.123184761548256e-03 6.950000000000000e-15 1.051242426441945e-15 PASS
Ly [step 75] -4.172386570339014e-02 -4.172386570339066e-02 4.960000000000000e-15 5.273559366969494e-16 PASS
Ly [step 100] -5.777037007127117e-02 -5.777037007126750e-02 4.070000000000000e-15 -3.670674875166924e-15 PASS
Lz [step 1] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Lz [step 25] -9.755996688405903e-02 -9.755996688405971e-02 6.400000000000000e-15 6.800116025829084e-16 PASS
Lz [step 50] 7.711998558591199e-03 7.711998558587046e-03 4.580000000000000e-15 4.152928001488476e-15 PASS
Lz [step 75] 7.208133272378889e-02 7.208133272378753e-02 5.780000000000000e-15 1.360023205165817e-15 PASS
Lz [step 100] 5.119788868443527e-02 5.119788868443480e-02 5.660000000000000e-15 4.649058915617843e-16 PASS
Q(-2)[step 1] -4.545137226010308e+00 -4.545137226010302e+00 4.550000000000000e-14 -6.217248937900877e-15 PASS
Q(-2)[step 25] -4.611689082743371e+00 -4.611689082743363e+00 4.610000000000000e-14 -7.993605777301127e-15 PASS
Q(-2)[step 50] -4.687399395140329e+00 -4.687399395140323e+00 4.690000000000000e-14 -6.217248937900877e-15 PASS
Q(-2)[step 75] -4.392452874733462e+00 -4.392452874733464e+00 4.390000000000000e-14 1.776356839400250e-15 PASS
Q(-2)[step 100] -4.181650789981206e+00 -4.181650789981192e+00 4.180000000000000e-14 -1.421085471520200e-14 PASS
Q(-1)[step 1] 4.178376526406830e+00 4.178376526406848e+00 4.180000000000000e-14 -1.776356839400250e-14 PASS
Q(-1)[step 25] 4.182321921047402e+00 4.182321921047410e+00 4.180000000000000e-14 -7.993605777301127e-15 PASS
Q(-1)[step 50] 4.130858295004435e+00 4.130858295004428e+00 4.130000000000000e-14 7.105427357601002e-15 PASS
Q(-1)[step 75] 4.065033999154412e+00 4.065033999154396e+00 4.070000000000000e-14 1.598721155460225e-14 PASS
Q(-1)[step 100] 4.091905436315873e+00 4.091905436315860e+00 4.090000000000000e-14 1.243449787580175e-14 PASS
Q( 0)[step 1] -7.137538508704746e+00 -7.137538508704713e+00 7.140000000000000e-14 -3.286260152890463e-14 PASS
Q( 0)[step 25] -7.469859499746010e+00 -7.469859499745980e+00 3.730000000000000e-13 -3.019806626980426e-14 PASS
Q( 0)[step 50] -7.808672080156442e+00 -7.808672080156406e+00 7.810000000000000e-14 -3.641531520770513e-14 PASS
Q( 0)[step 75] -7.739383133589497e+00 -7.739383133589480e+00 3.870000000000000e-13 -1.687538997430238e-14 PASS
Q( 0)[step 100] -7.647990218749468e+00 -7.647990218749506e+00 7.650000000000000e-14 3.730349362740526e-14 PASS
Q( 1)[step 1] -4.826117423972637e+00 -4.826117423972624e+00 4.830000000000000e-14 -1.243449787580175e-14 PASS
Q( 1)[step 25] -4.732913099704431e+00 -4.732913099704414e+00 4.730000000000000e-14 -1.776356839400250e-14 PASS
Q( 1)[step 50] -4.489483009608311e+00 -4.489483009608300e+00 4.490000000000000e-14 -1.154631945610163e-14 PASS
Q( 1)[step 75] -4.327506323667960e+00 -4.327506323667949e+00 4.330000000000000e-14 -1.065814103640150e-14 PASS
Q( 1)[step 100] -4.287562363821911e+00 -4.287562363821902e+00 4.290000000000000e-14 -8.881784197001252e-15 PASS
Q( 2)[step 1] 1.189093313557996e+01 1.189093313558002e+01 1.190000000000000e-13 -6.217248937900877e-14 PASS
Q( 2)[step 25] 1.233960558678200e+01 1.233960558678198e+01 1.230000000000000e-13 2.309263891220326e-14 PASS
Q( 2)[step 50] 1.278020775793099e+01 1.278020775793098e+01 1.280000000000000e-13 1.243449787580175e-14 PASS
Q( 2)[step 75] 1.272940168424053e+01 1.272940168424052e+01 1.270000000000000e-13 1.065814103640150e-14 PASS
Q( 2)[step 100] 1.255123999562225e+01 1.255123999562224e+01 1.260000000000000e-13 7.105427357601002e-15 PASS
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