Input 01-casida.06-casida_scalapack.inp

Commits > Commit d48128afc066bfe2b1bb5979f9ee62249e46c834 > Run cmake_foss_2022a_min_mpi

Matches

Name Value Reference Precision Difference Status
1st eps-diff E 3.007022120000000e-01 3.007022120000000e-01 1.500000000000000e-08 0.000000000000000e+00 PASS
3rd eps-diff E 3.537278300000000e-01 3.537278300000000e-01 1.770000000000000e-07 0.000000000000000e+00 PASS
1st eps-diff f 6.593511730000000e-22 0.000000000000000e+00 1.000000000000000e-08 6.593511730000000e-22 PASS
7th eps-diff f 3.149742600000000e-23 0.000000000000000e+00 1.000000000000000e-08 3.149742600000000e-23 PASS
1st Petersilka E 3.449669340000000e-01 3.449669340000000e-01 1.000000000000000e-08 0.000000000000000e+00 PASS
2nd Petersilka E 3.449669340000000e-01 3.449669340000000e-01 1.720000000000000e-08 0.000000000000000e+00 PASS
3rd Petersilka E 3.537278290000000e-01 3.537278290000000e-01 1.770000000000000e-08 0.000000000000000e+00 PASS
9th Petersilka E 4.543864810000000e-01 4.543864810000000e-01 2.270000000000000e-08 0.000000000000000e+00 PASS
1st Petersilka f 7.564106400000000e-22 7.552156500000000e-22 1.000000000000000e-08 1.194989999999987e-24 PASS
2nd Petersilka f 7.563752900000000e-22 7.554436610000000e-22 1.000000000000000e-08 9.316290000000148e-25 PASS
7th Petersilka f 4.964723860000000e-02 4.964723860000000e-02 2.480000000000000e-09 -6.938893903907228e-18 PASS
9th Petersilka f 4.974459740000000e-02 4.974459740000001e-02 2.490000000000000e-09 -6.938893903907228e-18 PASS
1st Casida E 3.421152140000000e-01 3.421152140000000e-01 1.710000000000000e-08 0.000000000000000e+00 PASS
2nd Casida E 3.537278290000000e-01 3.537278290000000e-01 1.770000000000000e-08 0.000000000000000e+00 PASS
3rd Casida E 3.738617100000000e-01 3.738617100000000e-01 1.870000000000000e-07 0.000000000000000e+00 PASS
1st Casida f 6.746025680000000e-22 0.000000000000000e+00 9.999999999999999e-22 6.746025680000000e-22 PASS
3rd Casida f 1.334263950000000e-29 0.000000000000000e+00 1.000000000000000e-27 1.334263950000000e-29 PASS
9th Casida f 4.597314950000000e-02 4.597407190000000e-02 1.610000000000000e-06 -9.224000000057631e-07 PASS
1st TDA E 3.449669340000000e-01 3.449669340000000e-01 1.720000000000000e-08 0.000000000000000e+00 PASS
2nd TDA E 3.537278290000000e-01 3.537278290000000e-01 1.770000000000000e-08 0.000000000000000e+00 PASS
3rd TDA E 3.744347120000000e-01 3.744347120000000e-01 1.870000000000000e-08 0.000000000000000e+00 PASS
1st TDA f 7.725045800000000e-22 0.000000000000000e+00 1.000000000000000e-08 7.725045800000000e-22 PASS
3rd TDA f 1.292395660000000e-29 0.000000000000000e+00 1.000000000000000e-08 1.292395660000000e-29 PASS
9th TDA f 4.588168610000000e-02 4.588262880000001e-02 1.640000000000000e-06 -9.427000000061803e-07 PASS
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