qchem

benchmarks

attribute set of submodule

Enable test

boolean

{
  benchmarks.<name>.enable = true;
}

attribute set

Shell code insterted at the beginning of the script

strings concatenated with "\n"

{
  benchmarks.<name>.extraSetup = "";
}

Parameters to create a benchmark for

list of attribute set

{
  benchmarks.<name>.params = [];
}

Options for sbatch

list of string

{
  benchmarks.<name>.slurmParams = [];
}

Label for test run

string

Generate a slurm script instead of standard shell script

boolean

{
  slurm = false;
}

Options for sbatch

list of string

{
  slurmParams = [];
}