# keywords: BIM, Coulomb, P3M, cgs, random_no_reject,
Particles:
    - Species:
        name: H
        number_density: 8.1e+27
        atomic_weight: 1.0
        num: 2500
        Z: 1.0
        temperature_eV: 14.68

    - Species:
        name: He
        number_density: 8.1e+27
        atomic_weight: 4
        num: 2500
        Z: 2.0
        temperature_eV: 14.68

Potential:
    type: Coulomb
    method: pppm
    rc: 1.7162e-09
    pppm_mesh: [32, 32, 32]
    pppm_aliases: [3,3,3]
    pppm_cao: [6,6,6]
    pppm_alpha_ewald: 2.0802e+09

Integrator:
    type: Verlet
    dt: 9.5e-20
    thermostat_type: berendsen
    thermalization_timestep: 100
    berendsen_tau: 5.0

Parameters:
    units: cgs
    load_method: random_no_reject
    boundary_conditions: periodic
    equilibration_steps: 5000
    production_steps: 100000
    eq_dump_step: 10
    prod_dump_step: 10

IO:
    verbose: yes
    simulations_dir: Simulations
    job_dir: HeH_sim

Observables:
  - RadialDistributionFunction:
      no_bins: 250

  - Thermodynamics:
      phase: production

  - StaticStructureFactor:
      max_ka_value: 12
      max_aa_value: 4.1
      no_slices: 4
      angle_averaging: principal_axis