Match comparison for z (O) (t=200 au) (match type 17040)

Commits > Commit b27eded3d993de0343d6f1363463df82eb2e5c60 > Input 10-dftbplus_verlet.01-water.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.468238009257000e-01 1.000000000000000e-04 -3.468238009257228e-01 1.102040441575680e-14 -3.468238009257277e-01 1.254552017826427e-14 PASS

Checks for this match

    Zen 4 builders have different values.
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Detailed information

Reference: -0.3468238009257, precision: 0.0001
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.468238009257402e-01 -4.024558464266192e-14 -4.024558464266192e-10 PASS
foss-ppc: [foss2022a-serial] -3.468238009257343e-01 -3.436140261214859e-14 -3.436140261214859e-10 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.468238009257151e-01 -1.515454428613339e-14 -1.515454428613339e-10 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.468238009257151e-01 -1.515454428613339e-14 -1.515454428613339e-10 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.468238009257151e-01 -1.515454428613339e-14 -1.515454428613339e-10 PASS
foss-mpi-full: [foss2023a-mpi] -3.468238009257151e-01 -1.515454428613339e-14 -1.515454428613339e-10 PASS
foss-mpi-opt-full: [foss2023a-mpi] -3.468238009257151e-01 -1.515454428613339e-14 -1.515454428613339e-10 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.468238009257402e-01 -4.024558464266192e-14 -4.024558464266192e-10 PASS
foss-opt-full: [foss2023a-serial] -3.468238009257151e-01 -1.515454428613339e-14 -1.515454428613339e-10 PASS