physnet-acetone.json

{
 "kind": "physnet",
 "name": "PhysNet (acetone dimers, MP2; valid RMSE 30 meV, 40 meV/\u00c5)",
 "source": "/private/tmp/claude-501/-Users-ericboittier-metawork-metatrain--claude-worktrees-magical-perlman-638818/d26ec339-a130-4a97-8b62-c67ceeafc49f/scratchpad/physnet-acetone-long.params.json",
 "config": {
  "features": 32,
  "max_degree": 0,
  "num_iterations": 3,
  "num_basis_functions": 24,
  "cutoff": 5.0,
  "max_atomic_number": 8,
  "charges": true,
  "n_refinement_blocks": 2,
  "zbl": true,
  "use_energy_bias": true,
  "include_electrostatics": true
 },
 "elements": [
  1,
  6,
  8
 ]
}