Input 15-electronic_system_restart.04-td_restart_part2.inp

Commits > Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 > Run foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766762e+01 -1.060686608766760e+01 1.060000000000000e-13 -1.776356839400250e-14 PASS
Energy [step 20] -1.060637353666430e+01 -1.060637353666430e+01 1.060000000000000e-13 -1.776356839400250e-15 PASS
Multipoles [step 0] 1.137160251217257e-15 -8.908015926463452e-16 4.090000000000000e-15 2.027961843863602e-15 PASS
Multipoles [step 20] -1.265509664058063e-01 -1.265509664058046e-01 4.850000000000000e-15 -1.665334536937735e-15 PASS
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