Input 15-crank_nicolson.04-freeze_states.inp

Commits > Commit adf3952efd5c2bdc0cc9389163d26498c92cbe64 > Run intel_omp_autotools: [intel2022a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.022657179873567e+01 -1.022657179873567e+01 1.020000000000000e-13 1.776356839400250e-15 PASS
Energy [step 5] -1.014067705119930e+01 -1.014067705119932e+01 1.010000000000000e-13 2.131628207280301e-14 PASS
Energy [step 10] -1.013381790798762e+01 -1.013381790798763e+01 1.010000000000000e-13 7.105427357601002e-15 PASS
Energy [step 15] -1.012563491015763e+01 -1.012563491015765e+01 1.010000000000000e-13 1.776356839400250e-14 PASS
Energy [step 20] -1.011739812323845e+01 -1.011739812323845e+01 1.010000000000000e-13 0.000000000000000e+00 PASS
Dipole [step 1] 3.288943336426931e-15 -1.039108394869460e-15 5.830000000000000e-15 4.328051731296391e-15 PASS
Dipole [step 5] -3.955586853259855e-01 -3.955586853259905e-01 6.110000000000000e-15 4.940492459581947e-15 PASS
Dipole [step 10] -7.406750729061492e-01 -7.406750729061549e-01 7.410000000000000e-15 5.662137425588298e-15 PASS
Dipole [step 15] -1.039084057464605e+00 -1.039084057464601e+00 1.140000000000000e-14 -4.440892098500626e-15 PASS
Dipole [step 20] -1.295829936532781e+00 -1.295829936532780e+00 1.300000000000000e-14 -8.881784197001252e-16 PASS
Compare to other inputs