Input 02-propagators.03-rungekutta2.inp

Commits > Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 > Run spack_intel-2023a_impi

Matches

Name Value Reference Precision Difference Status
Forces [step 1] 8.537673799433465e-02 8.537673799433354e-02 5.130000000000000e-15 1.110223024625157e-15 PASS
Forces [step 20] 7.965092836546006e-02 7.965092836546073e-02 3.180000000000000e-15 -6.661338147750939e-16 PASS
Energy [step 1] -1.060686608766765e+01 -1.060686608766762e+01 1.060000000000000e-13 -3.375077994860476e-14 PASS
Energy [step 20] -1.060634085760742e+01 -1.060634085760742e+01 1.060000000000000e-13 -5.329070518200751e-15 PASS
Multipoles [step 1] -1.170343729155372e-15 1.824331091466839e-16 4.490000000000000e-15 -1.352776838302056e-15 PASS
Multipoles [step 20] -1.266331163444885e-01 -1.266331163444866e-01 2.320000000000000e-15 -1.915134717478395e-15 PASS
Compare to other inputs