Input 06-caetrs.04-kick-tp2.inp

Commits > Commit 7a2379c5947d58fb2522a5e1a0c4903dfa35a523 > Run spack_foss-2023a_valgrind

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058495024056696e+01 -1.058495024056696e+01 1.060000000000000e-13 -1.776356839400250e-15 PASS
Energy [step 5] -1.042955032652509e+01 -1.042955032652510e+01 5.210000000000000e-13 7.105427357601002e-15 PASS
Energy [step 10] -1.042953043332984e+01 -1.042953043332980e+01 5.210000000000000e-13 -3.552713678800501e-14 PASS
Energy [step 15] -1.042951704575811e+01 -1.042951704575810e+01 5.210000000000000e-13 -8.881784197001252e-15 PASS
Energy [step 20] -1.042950992989120e+01 -1.042950992989120e+01 5.210000000000000e-14 -1.776356839400250e-15 PASS
Dipole [step 1] -2.426272073877134e-16 1.494990959640600e-16 6.600000000000000e-15 -3.921263033517734e-16 PASS
Dipole [step 5] -7.296268646591285e-01 -7.296268646591400e-01 3.650000000000000e-14 1.143529715363911e-14 PASS
Dipole [step 10] -1.339614999322742e+00 -1.339614999322740e+00 1.100000000000000e-14 -2.220446049250313e-15 PASS
Dipole [step 15] -1.834337869774246e+00 -1.834337869774243e+00 1.830000000000000e-14 -3.108624468950438e-15 PASS
Dipole [step 20] -2.215787801056114e+00 -2.215787801056108e+00 2.220000000000000e-14 -5.773159728050814e-15 PASS
Compare to other inputs