Input 01-casida.07-casida_elpa.inp

Commits > Commit 584f61e8603689505e758f366f49c21c2e481def > Run foss_mpi_debug_autotools: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
1st eps-diff E 3.007001490000000e-01 3.007001490000000e-01 1.500000000000000e-08 0.000000000000000e+00 PASS
3rd eps-diff E 3.537266430000000e-01 3.537266430000000e-01 1.770000000000000e-08 0.000000000000000e+00 PASS
1st eps-diff f 8.999360640000000e-22 0.000000000000000e+00 1.000000000000000e-08 8.999360640000000e-22 PASS
7th eps-diff f 4.379383170000000e-23 0.000000000000000e+00 1.000000000000000e-08 4.379383170000000e-23 PASS
1st Petersilka E 3.449651910000000e-01 3.449651910000000e-01 1.720000000000000e-08 0.000000000000000e+00 PASS
2nd Petersilka E 3.449651910000000e-01 3.449651910000000e-01 1.720000000000000e-08 0.000000000000000e+00 PASS
3rd Petersilka E 3.537266420000000e-01 3.537266420000000e-01 1.770000000000000e-08 0.000000000000000e+00 PASS
9th Petersilka E 4.543886450000000e-01 4.543886450000000e-01 2.270000000000000e-08 0.000000000000000e+00 PASS
1st Petersilka f 1.032413180000000e-21 0.000000000000000e+00 1.000000000000000e-08 1.032413180000000e-21 PASS
2nd Petersilka f 1.032449120000000e-21 0.000000000000000e+00 1.000000000000000e-08 1.032449120000000e-21 PASS
7th Petersilka f 4.964738300000000e-02 4.964738300000000e-02 2.480000000000000e-08 0.000000000000000e+00 PASS
9th Petersilka f 4.974314900000000e-02 4.974314900000000e-02 2.490000000000000e-08 0.000000000000000e+00 PASS
1st Casida E 3.421134150000000e-01 3.421134150000000e-01 1.710000000000000e-08 0.000000000000000e+00 PASS
2nd Casida E 3.537266420000000e-01 3.537266420000000e-01 1.770000000000000e-08 0.000000000000000e+00 PASS
3rd Casida E 3.738606100000000e-01 3.738606100000000e-01 1.870000000000000e-07 0.000000000000000e+00 PASS
1st Casida f 9.203704050000000e-22 0.000000000000000e+00 1.000000000000000e-08 9.203704050000000e-22 PASS
3rd Casida f 4.633438500000000e-30 0.000000000000000e+00 1.000000000000000e-08 4.633438500000000e-30 PASS
9th Casida f 4.597377650000000e-02 4.597269200000000e-02 1.720000000000000e-06 1.084499999998156e-06 PASS
1st TDA E 3.449651910000000e-01 3.449651910000000e-01 1.720000000000000e-08 0.000000000000000e+00 PASS
2nd TDA E 3.537266420000000e-01 3.537266420000000e-01 1.770000000000000e-08 0.000000000000000e+00 PASS
3rd TDA E 3.744336180000000e-01 3.744336180000000e-01 1.870000000000000e-08 0.000000000000000e+00 PASS
1st TDA f 1.054009860000000e-21 0.000000000000000e+00 1.000000000000000e-08 1.054009860000000e-21 PASS
3rd TDA f 3.899847790000000e-30 0.000000000000000e+00 1.000000000000000e-08 3.899847790000000e-30 PASS
9th TDA f 4.588235500000000e-02 4.588124680000000e-02 1.750000000000000e-06 1.108200000002335e-06 PASS
Compare to other inputs