Input 06-restart.07-restart_td_calc.inp

Commits > Commit 2ba62b4e5b3c7dac99914e88831daed234f640f9 > Run intel-2022b_impi

Matches

Name Value Reference Precision Difference Status
TD start 7.000000000000001e-01 7.000000000000000e-01 4.260000000000000e-05 1.110223024625157e-16 PASS
charge [up] 0.000000000000000e+00 0.000000000000000e+00 4.260000000000000e-05 0.000000000000000e+00 PASS
charge [dn] 9.999999999983180e-01 9.999999999983000e-01 4.260000000000000e-05 1.798561299892754e-14 PASS
<x> [dn] -6.969714937896479e-03 -6.969717724775000e-03 4.260000000000000e-05 2.786878520490144e-09 PASS
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