Input 03-td_self_consistent.02-etrs.inp

Commits > Commit c2137da3c7eed40c7b1d2dc83d2ec8c4c87fbf0f > Run intel_omp_autotools: [intel2023a-serial]

Matches

Name Value Reference Precision Difference Status
Multipoles [step 1] 1.520580536484850e-16 -2.341800490096620e-15 5.950000000000000e-15 2.493858543745105e-15 PASS
Multipoles [step 20] -1.265537116546926e-01 -1.265537116546943e-01 5.310000000000000e-15 1.665334536937735e-15 PASS
Forces [step 1] 8.537674454622390e-02 8.537674454622635e-02 9.040000000000000e-15 -2.442490654175344e-15 PASS
Forces [step 20] 7.966913104353646e-02 7.966913104353623e-02 9.530000000000000e-15 2.220446049250313e-16 PASS
Compare to other inputs