Match comparison for Total energy (match type 23239)

Commits > Commit d89ed1adec8f63937926022ba961c15ddb98b66b > Input 10-berkeleygw.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.177955062000000e+01 4.400000000000000e-08 -3.177955064000000e+01 2.160246913750234e-08 -3.177955063500000e+01 2.500000029215244e-08 PASS

Checks for this match

  • MPI builders have different values.
  • Mid point of values far away from reference. Recentering may be necessary.
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Detailed information

Reference: -31.779550620000002, precision: 0.000000044
Run Value Difference Relative difference Status
intel_omp_autotools: [intel2022a-serial] -3.177955065000000e+01 -2.999999892949745e-08 -6.818181574885784e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.177955061000000e+01 1.000000082740371e-08 2.272727460773571e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.177955066000000e+01 -3.999999975690116e-08 -9.090909035659356e-01 PASS