Input 16-sparskit.02-kick.inp

Commits > Commit 7a2cd2a0801cf0c9aaf759ff5aac90b0fe91b5f6 > Run spack_intel-2023a_serial

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058495024056696e+01 -1.058495024056700e+01 1.060000000000000e-13 3.552713678800501e-14 PASS
Energy [step 5] -1.042950048806361e+01 -1.042950048806360e+01 5.210000000000000e-14 -7.105427357601002e-15 PASS
Energy [step 10] -1.042949458890977e+01 -1.042949458890970e+01 5.210000000000000e-13 -6.572520305780927e-14 PASS
Energy [step 15] -1.042949286373715e+01 -1.042949286373710e+01 5.210000000000000e-13 -5.151434834260726e-14 PASS
Energy [step 20] -1.042949290569554e+01 -1.042949290569560e+01 5.210000000000000e-13 6.394884621840902e-14 PASS
Dipole [step 1] 1.961337281551189e-15 -4.333620525691201e-16 7.190000000000000e-15 2.394699334120309e-15 PASS
Dipole [step 5] -7.295378300608421e-01 -7.295378300608580e-01 3.650000000000000e-14 1.598721155460225e-14 PASS
Dipole [step 10] -1.339265738796747e+00 -1.339265738796780e+00 1.000000000000000e-10 3.286260152890463e-14 PASS
Dipole [step 15] -1.833833130199213e+00 -1.833833130199210e+00 9.170000000000000e-14 -3.330669073875470e-15 PASS
Dipole [step 20] -2.215306184110941e+00 -2.215306184110940e+00 1.110000000000000e-13 -8.881784197001252e-16 PASS
Compare to other inputs