Input 09-angular_momentum.02-td_gipaw.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run intel-2022a_omp_impi

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -2.319580964086080e+01 -2.319580964086080e+01 1.160000000000000e-12 0.000000000000000e+00 PASS
Energy [step 25] -2.306754404347961e+01 -2.306754404347960e+01 1.150000000000000e-12 -7.105427357601002e-15 PASS
Energy [step 50] -2.306760129759909e+01 -2.306760129759910e+01 1.150000000000000e-13 1.065814103640150e-14 PASS
Energy [step 75] -2.306766261145406e+01 -2.306766261145400e+01 1.150000000000000e-11 -6.039613253960852e-14 PASS
Energy [step 100] -2.306771709393763e+01 -2.306771709393760e+01 1.150000000000000e-12 -3.552713678800501e-14 PASS
Lx [step 1] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Lx [step 25] 4.378813412511263e-02 4.378813412511501e-02 5.110000000000000e-15 -2.373101715136272e-15 PASS
Lx [step 50] 7.223501819493813e-03 7.223501819495281e-03 5.350000000000000e-15 -1.467576060676379e-15 PASS
Lx [step 75] -1.948269821028839e-02 -1.948269821028625e-02 8.660000000000000e-15 -2.137179322403426e-15 PASS
Lx [step 100] -3.047203125192961e-02 -3.047203125192880e-02 6.000000000000000e-15 -8.118505867571457e-16 PASS
Ly [step 1] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Ly [step 25] -7.184641094808578e-02 -7.184641094808490e-02 4.130000000000000e-15 -8.743006318923108e-16 PASS
Ly [step 50] -7.117769255688480e-03 -7.117769255689680e-03 4.190000000000000e-15 1.199561283637962e-15 PASS
Ly [step 75] -4.172081222576134e-02 -4.172081222576260e-02 5.850000000000000e-15 1.255939796607208e-15 PASS
Ly [step 100] -5.777213620120894e-02 -5.777213620121158e-02 9.120000000000000e-15 2.636779683484747e-15 PASS
Lz [step 1] 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Lz [step 25] -9.756204043645227e-02 -9.756204043644941e-02 4.880000000000000e-15 -2.858824288409778e-15 PASS
Lz [step 50] 7.712993009730929e-03 7.712993009730000e-03 3.860000000000000e-13 9.289444213855802e-16 PASS
Lz [step 75] 7.208148635269117e-02 7.208148635269590e-02 8.660000000000000e-15 -4.732325642464730e-15 PASS
Lz [step 100] 5.119310678838061e-02 5.119310678838490e-02 9.139999999999999e-15 -4.288236432614667e-15 PASS
Q(-2)[step 1] -4.545099285100731e+00 -4.545099285100750e+00 2.270000000000000e-13 1.865174681370263e-14 PASS
Q(-2)[step 25] -4.611640700089462e+00 -4.611640700000000e+00 2.310000000000000e-06 -8.946265950271481e-11 PASS
Q(-2)[step 50] -4.687349753661730e+00 -4.687349753662680e+00 1.000000000000000e-12 9.503509090791340e-13 PASS
Q(-2)[step 75] -4.392410657028169e+00 -4.392410657028165e+00 4.390000000000000e-14 -3.552713678800501e-15 PASS
Q(-2)[step 100] -4.181622432525412e+00 -4.181622432525399e+00 4.180000000000000e-14 -1.243449787580175e-14 PASS
Q(-1)[step 1] 4.178298639726172e+00 4.178298639726180e+00 2.090000000000000e-13 -7.993605777301127e-15 PASS
Q(-1)[step 25] 4.182239910020078e+00 4.182239910020090e+00 2.090000000000000e-13 -1.243449787580175e-14 PASS
Q(-1)[step 50] 4.130776137010009e+00 4.130776137010026e+00 4.130000000000000e-14 -1.687538997430238e-14 PASS
Q(-1)[step 75] 4.064950972547098e+00 4.064950972547106e+00 4.390000000000000e-14 -8.881784197001252e-15 PASS
Q(-1)[step 100] 4.091822670232398e+00 4.091822670233270e+00 1.000000000000000e-12 -8.721912081455230e-13 PASS
Q( 0)[step 1] -7.137608303968182e+00 -7.137608303968200e+00 3.570000000000000e-12 1.776356839400250e-14 PASS
Q( 0)[step 25] -7.469922011510177e+00 -7.469922011510200e+00 3.730000000000000e-13 2.309263891220326e-14 PASS
Q( 0)[step 50] -7.808731999289103e+00 -7.808731999289140e+00 3.900000000000000e-13 3.730349362740526e-14 PASS
Q( 0)[step 75] -7.739446597993694e+00 -7.739446597993680e+00 3.870000000000000e-13 -1.332267629550188e-14 PASS
Q( 0)[step 100] -7.648056564564786e+00 -7.648056564565430e+00 1.000000000000000e-12 6.448175327022909e-13 PASS
Q( 1)[step 1] -4.826111654801445e+00 -4.826111654803580e+00 2.370000000000000e-12 2.135180920959101e-12 PASS
Q( 1)[step 25] -4.732913242624225e+00 -4.732913242624240e+00 2.370000000000000e-13 1.509903313490213e-14 PASS
Q( 1)[step 50] -4.489489823162545e+00 -4.489489823162540e+00 2.240000000000000e-13 -5.329070518200751e-15 PASS
Q( 1)[step 75] -4.327519808485437e+00 -4.327519808485425e+00 4.590000000000000e-14 -1.243449787580175e-14 PASS
Q( 1)[step 100] -4.287582681175261e+00 -4.287582681175240e+00 2.140000000000000e-13 -2.042810365310288e-14 PASS
Q( 2)[step 1] 1.189101961133260e+01 1.189101961133255e+01 1.190000000000000e-13 5.329070518200751e-14 PASS
Q( 2)[step 25] 1.233968578911677e+01 1.233968578911680e+01 6.170000000000000e-13 -3.197442310920451e-14 PASS
Q( 2)[step 50] 1.278029271318787e+01 1.278029271318795e+01 1.280000000000000e-13 -8.348877145181177e-14 PASS
Q( 2)[step 75] 1.272948913185597e+01 1.272948913185600e+01 6.360000000000000e-12 -2.664535259100376e-14 PASS
Q( 2)[step 100] 1.255133064623374e+01 1.255133064623380e+01 6.280000000000001e-13 -5.506706202140776e-14 PASS
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