Input 16-sparskit.02-kick.inp

Commits > Commit dd0acda4415b0ab64c529ca4a26922f9782edb94 > Run spack_foss-2023a_valgrind

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058497392618077e+01 -1.058497392618078e+01 1.060000000000000e-13 5.329070518200751e-15 PASS
Energy [step 5] -1.042952412811269e+01 -1.042952412811269e+01 1.040000000000000e-13 0.000000000000000e+00 PASS
Energy [step 10] -1.042951822881432e+01 -1.042951822881430e+01 1.040000000000000e-13 -2.309263891220326e-14 PASS
Energy [step 15] -1.042951650355474e+01 -1.042951650355473e+01 1.040000000000000e-13 -1.421085471520200e-14 PASS
Energy [step 20] -1.042951654541482e+01 -1.042951654541481e+01 1.040000000000000e-13 -1.065814103640150e-14 PASS
Dipole [step 1] 2.439070612961138e-15 -4.333620525691201e-16 7.190000000000000e-15 2.872432665530258e-15 PASS
Dipole [step 5] -7.295369601119560e-01 -7.295369601119552e-01 7.300000000000000e-15 -7.771561172376096e-16 PASS
Dipole [step 10] -1.339262937921843e+00 -1.339262937921843e+00 1.340000000000000e-14 -4.440892098500626e-16 PASS
Dipole [step 15] -1.833828192687685e+00 -1.833828192687674e+00 1.830000000000000e-14 -1.088018564132653e-14 PASS
Dipole [step 20] -2.215299399796882e+00 -2.215299399796875e+00 2.220000000000000e-14 -6.661338147750939e-15 PASS
Compare to other inputs