Match comparison for Fz (O) (t=200 au) (match type 17049)

Commits > Commit 77b19a812457519ffe2e63888ffe5f5b10958dc8 > Input 10-dftbplus_verlet.01-water.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-9.060493832761000e-03 1.000000000000000e-04 -9.060493832295789e-03 4.386237983134447e-13 -9.060493832311611e-03 8.075484725367232e-13 PASS
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Detailed information

Reference: -0.009060493832761, precision: 0.0001
Run Value Difference Relative difference Status
foss-2022a_ppc -9.060493833119160e-03 -3.581596824675515e-13 -3.581596824675515e-09 PASS
cmake_foss_2022a_full_serial -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
cmake_foss_2022a_full_mpi -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
eb_foss-2022a -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
eb_foss-2022b_libxc6 -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
foss-2022a_opt -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
eb_fosscuda-2022a -9.060493832599686e-03 1.613136707545593e-13 1.613136707545593e-09 PASS
intel-2022a -9.060493832018623e-03 7.423766462677506e-13 7.423766462677506e-09 PASS
foss-2022a_omp -9.060493831504063e-03 1.256937262605895e-12 1.256937262605895e-08 PASS
intel-2022b -9.060493833004946e-03 -2.439454888092385e-13 -2.439454888092385e-09 PASS
spack_foss-2022a_serial -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
intel-2022a_omp -9.060493832018623e-03 7.423766462677506e-13 7.423766462677506e-09 PASS
spack_foss-2022a_serial_opt -9.060493832338840e-03 4.221605703902398e-13 4.221605703902398e-09 PASS
spack_foss-2022a_serial_omp -9.060493831504063e-03 1.256937262605895e-12 1.256937262605895e-08 PASS