Match comparison for x (H) (t=200 au) (match type 17044)

Commits > Commit a02211b136400868a3f91e422c586cb9ab194975 > Input 10-dftbplus_verlet.01-water.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.447837823412000e+00 1.000000000000000e-04 -1.447837823412028e+00 0.000000000000000e+00 -1.447837823412028e+00 0.000000000000000e+00 PASS
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Detailed information

Reference: -1.447837823412, precision: 0.0001
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.447837823412028e+00 -2.819966482547898e-14 -2.819966482547898e-10 PASS