Input 16-sparskit.02-kick.inp

Commits > Commit 9c5e1a9ae4a97d24a493b8c6c0caa96edfef5d41 > Run intel_autotools: [intel2023a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058497392618076e+01 -1.058497392618078e+01 1.060000000000000e-13 1.598721155460225e-14 PASS
Energy [step 5] -1.042952412811269e+01 -1.042952412811269e+01 1.040000000000000e-13 1.776356839400250e-15 PASS
Energy [step 10] -1.042951822881432e+01 -1.042951822881430e+01 1.040000000000000e-13 -1.776356839400250e-14 PASS
Energy [step 15] -1.042951650355472e+01 -1.042951650355473e+01 1.040000000000000e-13 7.105427357601002e-15 PASS
Energy [step 20] -1.042951654541481e+01 -1.042951654541481e+01 1.040000000000000e-13 -3.552713678800501e-15 PASS
Dipole [step 1] 2.888045698586344e-15 -4.333620525691201e-16 7.190000000000000e-15 3.321407751155464e-15 PASS
Dipole [step 5] -7.295369601119543e-01 -7.295369601119552e-01 7.300000000000000e-15 8.881784197001252e-16 PASS
Dipole [step 10] -1.339262937921837e+00 -1.339262937921843e+00 1.340000000000000e-14 6.439293542825908e-15 PASS
Dipole [step 15] -1.833828192687673e+00 -1.833828192687674e+00 1.830000000000000e-14 6.661338147750939e-16 PASS
Dipole [step 20] -2.215299399796870e+00 -2.215299399796875e+00 2.220000000000000e-14 4.884981308350689e-15 PASS
Compare to other inputs