Input 02-propagators.02-cnsparskit.inp

Commits > Commit 61d12a07bb2f18211cbe349e5d87c7e10e0bf297 > Run intel_autotools: [intel2023a-serial]

Matches

Name Value Reference Precision Difference Status
Forces [step 1] 8.537673799433243e-02 8.537673799433354e-02 1.250000000000000e-14 -1.110223024625157e-15 PASS
Forces [step 20] 7.964959635257385e-02 7.964959635257580e-02 7.040000000000000e-15 -1.956768080901838e-15 PASS
Energy [step 1] -1.060686608766761e+01 -1.060686608766762e+01 1.060000000000000e-13 7.105427357601002e-15 PASS
Energy [step 20] -1.060637261154881e+01 -1.060637261154880e+01 1.060000000000000e-13 -7.105427357601002e-15 PASS
Multipoles [step 1] 2.291175062174578e-15 5.879834888021430e-16 4.510000000000000e-15 1.703191573372434e-15 PASS
Multipoles [step 20] -1.265304528942167e-01 -1.265304528942195e-01 6.870000000000000e-15 2.775557561562891e-15 PASS
Compare to other inputs