{
  "schema": "ferrofinder.endpoint_parent_recovery.v4_variable_cell",
  "status": "complete",
  "input_atom_count": 12,
  "input_formula": "As2Cs2F8",
  "input_spacegroup": "P2_1",
  "input_pointgroup": "2",
  "input_is_polar_point_group": true,
  "input_energy_eV": -53.89317891835103,
  "input_cartesian_polarization_e_A2": [
    3.780532767339795e-11,
    -0.001589934785984481,
    -1.368675695338127e-10
  ],
  "input_reduced_polarization": [
    -7.595203465343134e-10,
    -0.0870556680451967,
    -4.544784617557341e-09
  ],
  "input_formal_targets": [
    {
      "orbit_id": 0,
      "representative_formal_class": [
        0.0,
        0.0,
        0.0
      ],
      "target_reduced_polarization": [
        0.0,
        0.0,
        0.0
      ]
    },
    {
      "orbit_id": 1,
      "representative_formal_class": [
        0.0,
        0.5,
        0.0
      ],
      "target_reduced_polarization": [
        0.0,
        -0.5,
        0.0
      ]
    },
    {
      "orbit_id": 2,
      "representative_formal_class": [
        0.0,
        0.0,
        0.5
      ],
      "target_reduced_polarization": [
        0.0,
        0.0,
        -0.5
      ]
    },
    {
      "orbit_id": 3,
      "representative_formal_class": [
        0.5,
        0.0,
        0.0
      ],
      "target_reduced_polarization": [
        -0.5,
        0.0,
        0.0
      ]
    },
    {
      "orbit_id": 4,
      "representative_formal_class": [
        0.0,
        0.5,
        0.5
      ],
      "target_reduced_polarization": [
        0.0,
        -0.5,
        -0.5
      ]
    },
    {
      "orbit_id": 5,
      "representative_formal_class": [
        0.5,
        0.5,
        0.0
      ],
      "target_reduced_polarization": [
        -0.5,
        -0.5,
        0.0
      ]
    },
    {
      "orbit_id": 6,
      "representative_formal_class": [
        0.5,
        0.0,
        0.5
      ],
      "target_reduced_polarization": [
        -0.5,
        0.0,
        -0.5
      ]
    },
    {
      "orbit_id": 7,
      "representative_formal_class": [
        0.5,
        0.5,
        0.5
      ],
      "target_reduced_polarization": [
        -0.5,
        -0.5,
        -0.5
      ]
    }
  ],
  "parent_candidates": [
    {
      "candidate_id": "inversion_parent_endpoint_00",
      "source": "same_species_inversion_center_projection_from_endpoint",
      "spacegroup": "P2_1/m",
      "spacegroup_number": 11,
      "pointgroup": "2/m",
      "has_inversion": true,
      "is_polar_point_group": false,
      "nonpolar_parent_hypothesis": true,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        0.0,
        0.0,
        0.0
      ],
      "formal_class": [
        0.0,
        0.0,
        0.0
      ],
      "target_residual": 1.634630844626559e-16,
      "parent_symmetrization_rmsd_A": 0.30584634084927315,
      "parent_cell_rmsd_A": 0.0,
      "energy_eV": -52.425550969721925,
      "reduced_polarization": [
        -6.872665728327962e-17,
        1.4795598519657023e-16,
        1.0288488967010106e-17
      ],
      "cartesian_polarization_e_A2": [
        -1.859045826264422e-18,
        2.702183245972016e-18,
        3.0984097104407036e-19
      ],
      "ranking_score": 0.3058463408492735
    },
    {
      "candidate_id": "inversion_parent_endpoint_01",
      "source": "same_species_inversion_center_projection_from_endpoint",
      "spacegroup": "P2_1/m",
      "spacegroup_number": 11,
      "pointgroup": "2/m",
      "has_inversion": true,
      "is_polar_point_group": false,
      "nonpolar_parent_hypothesis": true,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        0.0,
        0.0,
        0.0
      ],
      "formal_class": [
        0.0,
        0.0,
        0.0
      ],
      "target_residual": 2.5312109181938085e-15,
      "parent_symmetrization_rmsd_A": 0.6464704174196816,
      "parent_cell_rmsd_A": 0.0,
      "energy_eV": -41.74740727422766,
      "reduced_polarization": [
        2.75016792749668e-16,
        2.510835738703711e-15,
        -1.646158234721617e-16
      ],
      "cartesian_polarization_e_A2": [
        8.98538816027804e-18,
        4.5856463714522413e-17,
        -4.957455536705126e-18
      ],
      "ranking_score": 0.6464704174196867
    },
    {
      "candidate_id": "inversion_parent_endpoint_02",
      "source": "same_species_inversion_center_projection_from_endpoint",
      "spacegroup": "P2_1/c",
      "spacegroup_number": 14,
      "pointgroup": "2/m",
      "has_inversion": true,
      "is_polar_point_group": false,
      "nonpolar_parent_hypothesis": true,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        0.0,
        0.0,
        0.0
      ],
      "formal_class": [
        0.0,
        0.0,
        0.0
      ],
      "target_residual": 2.3899831166172572e-15,
      "parent_symmetrization_rmsd_A": 0.6623973530115987,
      "parent_cell_rmsd_A": 0.0,
      "energy_eV": -27.052586209963522,
      "reduced_polarization": [
        2.1072292838904686e-15,
        -1.125352054058645e-15,
        -7.201942276907074e-17
      ],
      "cartesian_polarization_e_A2": [
        5.395105908304875e-17,
        -2.055278441259e-17,
        -2.1688867973084923e-18
      ],
      "ranking_score": 0.6623973530116035
    },
    {
      "candidate_id": "bec_projection_00",
      "source": "MACEField_BEC_backprojection",
      "spacegroup": "P2_1",
      "spacegroup_number": 4,
      "pointgroup": "2",
      "has_inversion": false,
      "is_polar_point_group": true,
      "nonpolar_parent_hypothesis": false,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        0.0,
        0.0,
        0.0
      ],
      "formal_class": [
        0.0,
        0.0,
        0.0
      ],
      "target_residual": 0.0004402769492280189,
      "parent_symmetrization_rmsd_A": 0.03533476065595123,
      "parent_cell_rmsd_A": 0.017435542859223482,
      "energy_eV": -53.75938441620032,
      "reduced_polarization": [
        1.348179520985292e-10,
        0.0004402769492279898,
        8.633578208242593e-11
      ],
      "cartesian_polarization_e_A2": [
        2.2970568563765165e-12,
        8.037536390449167e-06,
        2.581819990606097e-12
      ],
      "ranking_score": 0.5405742002692131
    },
    {
      "candidate_id": "inversion_parent_bec_00_00",
      "source": "same_species_inversion_center_projection_after_BEC",
      "spacegroup": "P2_1/m",
      "spacegroup_number": 11,
      "pointgroup": "2/m",
      "has_inversion": true,
      "is_polar_point_group": false,
      "nonpolar_parent_hypothesis": true,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        0.0,
        0.0,
        0.0
      ],
      "formal_class": [
        0.0,
        0.0,
        0.0
      ],
      "target_residual": 2.9864673955046717e-15,
      "parent_symmetrization_rmsd_A": 0.3058692967675892,
      "parent_cell_rmsd_A": 0.017435542859223482,
      "energy_eV": -52.33293113398916,
      "reduced_polarization": [
        1.6285863475151972e-15,
        1.6205520837423708e-15,
        1.908010732930459e-15
      ],
      "cartesian_polarization_e_A2": [
        1.6947600401483042e-17,
        2.9584211406365215e-17,
        5.710827771651256e-17
      ],
      "ranking_score": 0.3102281824824011
    },
    {
      "candidate_id": "inversion_parent_bec_00_01",
      "source": "same_species_inversion_center_projection_after_BEC",
      "spacegroup": "P2_1/m",
      "spacegroup_number": 11,
      "pointgroup": "2/m",
      "has_inversion": true,
      "is_polar_point_group": false,
      "nonpolar_parent_hypothesis": true,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        0.0,
        0.0,
        0.0
      ],
      "formal_class": [
        0.0,
        0.0,
        0.0
      ],
      "target_residual": 4.596875937613938e-16,
      "parent_symmetrization_rmsd_A": 0.6465167072838832,
      "parent_cell_rmsd_A": 0.017435542859223482,
      "energy_eV": -42.8841436848899,
      "reduced_polarization": [
        -2.7249694840733657e-16,
        3.600868332026177e-16,
        -8.599749717834698e-17
      ],
      "cartesian_polarization_e_A2": [
        -5.751912863533639e-18,
        6.5736147011813016e-18,
        -2.567818242648946e-18
      ],
      "ranking_score": 0.65087559299869
    },
    {
      "candidate_id": "bec_projection_01",
      "source": "MACEField_BEC_backprojection",
      "spacegroup": "P2_1",
      "spacegroup_number": 4,
      "pointgroup": "2",
      "has_inversion": false,
      "is_polar_point_group": true,
      "nonpolar_parent_hypothesis": false,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        0.0,
        -0.5,
        0.0
      ],
      "formal_class": [
        0.0,
        0.5,
        0.0
      ],
      "target_residual": 7.553212962130297e-05,
      "parent_symmetrization_rmsd_A": 0.16448733729397108,
      "parent_cell_rmsd_A": 0.07654935171493944,
      "energy_eV": -49.85281116252259,
      "reduced_polarization": [
        1.4574313810150962e-12,
        -0.4999244678703787,
        -9.6347952157603e-14
      ],
      "cartesian_polarization_e_A2": [
        1.0814608067279783e-12,
        -0.009147732687493495,
        -2.0846025419798317e-12
      ],
      "ranking_score": 0.6837757394819486
    },
    {
      "candidate_id": "bec_projection_02",
      "source": "MACEField_BEC_backprojection",
      "spacegroup": "P1",
      "spacegroup_number": 1,
      "pointgroup": "1",
      "has_inversion": false,
      "is_polar_point_group": true,
      "nonpolar_parent_hypothesis": false,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        0.0,
        0.0,
        -0.5
      ],
      "formal_class": [
        0.0,
        0.0,
        0.5
      ],
      "target_residual": 0.0019474518978209471,
      "parent_symmetrization_rmsd_A": 0.4883632143398143,
      "parent_cell_rmsd_A": 0.20604619027409138,
      "energy_eV": -43.03841427554002,
      "reduced_polarization": [
        -0.0009540193289147178,
        0.0013554612484115054,
        -0.5010223212892424
      ],
      "cartesian_polarization_e_A2": [
        0.006236778958156369,
        0.0003471388567093781,
        -0.015155414172532975
      ],
      "ranking_score": 1.0437696657039792
    },
    {
      "candidate_id": "bec_projection_03",
      "source": "MACEField_BEC_backprojection",
      "spacegroup": "P1",
      "spacegroup_number": 1,
      "pointgroup": "1",
      "has_inversion": false,
      "is_polar_point_group": true,
      "nonpolar_parent_hypothesis": false,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        -0.5,
        0.0,
        0.0
      ],
      "formal_class": [
        0.5,
        0.0,
        0.0
      ],
      "target_residual": 0.0006878837144862748,
      "parent_symmetrization_rmsd_A": 0.36918562335139327,
      "parent_cell_rmsd_A": 0.12476529514041074,
      "energy_eV": -46.20158536052306,
      "reduced_polarization": [
        -0.4997796601020415,
        0.0002065501877761135,
        0.000618038311071996
      ],
      "cartesian_polarization_e_A2": [
        -0.012591566739529445,
        0.000160917314013794,
        1.954715929042635e-05
      ],
      "ranking_score": 0.9017527145654685
    },
    {
      "candidate_id": "bec_projection_04",
      "source": "MACEField_BEC_backprojection",
      "spacegroup": "P1",
      "spacegroup_number": 1,
      "pointgroup": "1",
      "has_inversion": false,
      "is_polar_point_group": true,
      "nonpolar_parent_hypothesis": false,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        0.0,
        -0.5,
        -0.5
      ],
      "formal_class": [
        0.0,
        0.5,
        0.5
      ],
      "target_residual": 0.02319129170251823,
      "parent_symmetrization_rmsd_A": 0.5623364825369662,
      "parent_cell_rmsd_A": 0.30661889933789144,
      "energy_eV": -34.216318448556194,
      "reduced_polarization": [
        -0.015078162153656975,
        -0.4834344418809933,
        -0.5060056074717825
      ],
      "cartesian_polarization_e_A2": [
        0.005681710611547351,
        -0.008803047172018168,
        -0.0160195233860842
      ],
      "ranking_score": 1.1853737907764756
    },
    {
      "candidate_id": "bec_projection_05",
      "source": "MACEField_BEC_backprojection",
      "spacegroup": "P1",
      "spacegroup_number": 1,
      "pointgroup": "1",
      "has_inversion": false,
      "is_polar_point_group": true,
      "nonpolar_parent_hypothesis": false,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        -0.5,
        -0.5,
        0.0
      ],
      "formal_class": [
        0.5,
        0.5,
        0.0
      ],
      "target_residual": 0.0002983039920397284,
      "parent_symmetrization_rmsd_A": 0.47616269180360915,
      "parent_cell_rmsd_A": 0.18629079384506456,
      "energy_eV": -44.02179407002628,
      "reduced_polarization": [
        -0.5000828671213162,
        -0.5001886499086089,
        -0.0002157070324617544
      ],
      "cartesian_polarization_e_A2": [
        -0.012919468661611403,
        -0.009014283889088577,
        -0.0002980910051978305
      ],
      "ranking_score": 1.0233319982489548
    },
    {
      "candidate_id": "bec_projection_06",
      "source": "MACEField_BEC_backprojection",
      "spacegroup": "P1",
      "spacegroup_number": 1,
      "pointgroup": "1",
      "has_inversion": false,
      "is_polar_point_group": true,
      "nonpolar_parent_hypothesis": false,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        -0.5,
        0.0,
        -0.5
      ],
      "formal_class": [
        0.5,
        0.0,
        0.5
      ],
      "target_residual": 0.09868427135077816,
      "parent_symmetrization_rmsd_A": 0.46435619589240024,
      "parent_cell_rmsd_A": 0.13880638905767664,
      "energy_eV": -37.91031792483793,
      "reduced_polarization": [
        -0.4166225431820463,
        0.00038842341000316173,
        -0.4472114194748633
      ],
      "cartesian_polarization_e_A2": [
        -0.005045886318001597,
        -0.00017128437020789153,
        -0.013678747512121595
      ],
      "ranking_score": 1.1964263358583758
    },
    {
      "candidate_id": "bec_projection_07",
      "source": "MACEField_BEC_backprojection",
      "spacegroup": "P1",
      "spacegroup_number": 1,
      "pointgroup": "1",
      "has_inversion": false,
      "is_polar_point_group": true,
      "nonpolar_parent_hypothesis": false,
      "symmetry_tolerance_A": null,
      "target_reduced_polarization": [
        -0.5,
        -0.5,
        -0.5
      ],
      "formal_class": [
        0.5,
        0.5,
        0.5
      ],
      "target_residual": 0.034179247265473715,
      "parent_symmetrization_rmsd_A": 0.6234852121051465,
      "parent_cell_rmsd_A": 0.15879355068009987,
      "energy_eV": -30.782539114026793,
      "reduced_polarization": [
        -0.4835805154466952,
        -0.47805407723031523,
        -0.47957947247436516
      ],
      "cartesian_polarization_e_A2": [
        -0.006625443730564274,
        -0.008970310628475168,
        -0.015278120086871422
      ],
      "ranking_score": 1.231542094306119
    }
  ],
  "formal_branches": [
    {
      "orbit_id": 0,
      "formal_class": [
        0.0,
        0.0,
        0.0
      ],
      "formal_classes_in_orbit": [
        [
          0.0,
          0.0,
          0.0
        ]
      ],
      "target_reduced_polarization": [
        0.0,
        0.0,
        0.0
      ],
      "bec_backprojection": {
        "converged_to_target": true,
        "history": [
          {
            "iteration": 0,
            "reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "branch_aligned_reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "target_residual": 0.08705566804519682,
            "energy_eV": -53.89317891835103,
            "max_atomic_step_A": 0.03926748018853199,
            "max_log_strain_component": 0.0050842553992112806,
            "step_scale": 1.0,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0050972021579365,
              1.001539499611414,
              0.9988888674686285
            ],
            "cell_volume_ratio": 1.0055260334042704,
            "cell_rmsd_from_input_A": 0.017435542859223482
          },
          {
            "iteration": 1,
            "reduced_polarization": [
              1.348179520985292e-10,
              0.0004402769492279898,
              8.633578208242593e-11
            ],
            "branch_aligned_reduced_polarization": [
              1.348179520985292e-10,
              0.0004402769492279898,
              8.633578208242593e-11
            ],
            "target_residual": 0.0004402769492280189,
            "energy_eV": -53.75938441620032
          }
        ],
        "iterations": 1
      },
      "parent": {
        "candidate_id": "inversion_parent_endpoint_00",
        "source": "same_species_inversion_center_projection_from_endpoint",
        "spacegroup": "P2_1/m",
        "spacegroup_number": 11,
        "pointgroup": "2/m",
        "has_inversion": true,
        "is_polar_point_group": false,
        "nonpolar_parent_hypothesis": true,
        "symmetry_tolerance_A": null,
        "target_reduced_polarization": [
          0.0,
          0.0,
          0.0
        ],
        "formal_class": [
          0.0,
          0.0,
          0.0
        ],
        "target_residual": 1.634630844626559e-16,
        "parent_symmetrization_rmsd_A": 0.30584634084927315,
        "parent_cell_rmsd_A": 0.0,
        "energy_eV": -52.425550969721925,
        "reduced_polarization": [
          -6.872665728327962e-17,
          1.4795598519657023e-16,
          1.0288488967010106e-17
        ],
        "cartesian_polarization_e_A2": [
          -1.859045826264422e-18,
          2.702183245972016e-18,
          3.0984097104407036e-19
        ],
        "ranking_score": 0.3058463408492735
      },
      "branch_status": "sampled",
      "incoming": {
        "reached": true,
        "construction": "variable_cell_linear_interpolation",
        "continuation_fractions": [
          0.0,
          0.125,
          0.25,
          0.375,
          0.5,
          0.625,
          0.75,
          0.875,
          1.0
        ],
        "energies_eV": [
          -53.89317891835103,
          -53.811322418397566,
          -53.62617399895686,
          -53.39459806512255,
          -53.149314470427626,
          -52.902503670077884,
          -52.6688070545464,
          -52.49197679429941,
          -52.42555096972195
        ],
        "cartesian_polarizations_e_A2": [
          [
            3.780532225118096e-11,
            -0.001589934785984477,
            -1.3686757108301757e-10
          ],
          [
            3.438516376149702e-11,
            -0.0005740218034041779,
            -1.2132552808929108e-10
          ],
          [
            3.034401321881904e-11,
            0.0004360683402159409,
            -1.0522106455349412e-10
          ],
          [
            2.5603735340190423e-11,
            0.0013495314582147012,
            -8.857424402114602e-11
          ],
          [
            2.043842061261294e-11,
            0.0020190189591827875,
            -7.14923920996461e-11
          ],
          [
            1.5202841130785157e-11,
            0.0022481528842301646,
            -5.410971759332578e-11
          ],
          [
            1.0107923098071473e-11,
            0.0019060258738560053,
            -3.647725518312819e-11
          ],
          [
            5.0941635699491906e-12,
            0.0010744805743806121,
            -1.8451180718227288e-11
          ],
          [
            -5.2672965077491955e-18,
            -2.1463080847601883e-18,
            -3.428906746221045e-17
          ]
        ],
        "raw_reduced_polarization": [
          [
            -7.595205875123987e-10,
            -0.08705566804519649,
            -4.5447846689997865e-09
          ],
          [
            -6.386018229343476e-10,
            -0.031430126573975745,
            -4.0287001197972614e-09
          ],
          [
            -5.330583707678768e-10,
            0.023876589785632493,
            -3.4939399980182196e-09
          ],
          [
            -4.4632542390265443e-10,
            0.07389256696471576,
            -2.9411705279067282e-09
          ],
          [
            -3.6928863073911397e-10,
            0.1105498450860933,
            -2.373955532297077e-09
          ],
          [
            -2.900729241511775e-10,
            0.12309589860517905,
            -1.796751509624534e-09
          ],
          [
            -2.0114298374701447e-10,
            0.10436299477353782,
            -1.2112531026280776e-09
          ],
          [
            -1.0248623717258838e-10,
            0.05883236534533176,
            -6.126845284795788e-10
          ],
          [
            -7.757308511393068e-16,
            -1.1751946419230596e-16,
            -1.138592779015785e-15
          ]
        ],
        "unwrapped_reduced_polarization": [
          [
            -7.595205875123987e-10,
            -0.08705566804519649,
            -4.5447846689997865e-09
          ],
          [
            -6.386018229343476e-10,
            -0.031430126573975745,
            -4.0287001197972614e-09
          ],
          [
            -5.330583707678768e-10,
            0.023876589785632493,
            -3.4939399980182196e-09
          ],
          [
            -4.4632542390265443e-10,
            0.07389256696471576,
            -2.9411705279067282e-09
          ],
          [
            -3.6928863073911397e-10,
            0.1105498450860933,
            -2.373955532297077e-09
          ],
          [
            -2.900729241511775e-10,
            0.12309589860517905,
            -1.796751509624534e-09
          ],
          [
            -2.0114298374701447e-10,
            0.10436299477353782,
            -1.2112531026280776e-09
          ],
          [
            -1.0248623717258838e-10,
            0.05883236534533176,
            -6.126845284795788e-10
          ],
          [
            -7.757308511407003e-16,
            -1.1796119636642288e-16,
            -1.1385927790538715e-15
          ]
        ],
        "berry_integer_shifts": [
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ]
        ],
        "folded_reduced_polarization": [
          [
            -7.595206130694976e-10,
            -0.08705566804519649,
            -4.5447846597213015e-09
          ],
          [
            -6.386018380766245e-10,
            -0.03143012657397576,
            -4.028700095748405e-09
          ],
          [
            -5.330583752183315e-10,
            0.02387658978563245,
            -3.4939399706779284e-09
          ],
          [
            -4.463254210662626e-10,
            0.0738925669647158,
            -2.941170529346948e-09
          ],
          [
            -3.692886552109087e-10,
            0.11054984508609333,
            -2.37395553215336e-09
          ],
          [
            -2.9007291013627423e-10,
            0.12309589860517911,
            -1.7967515253403121e-09
          ],
          [
            -2.011429911519258e-10,
            0.10436299477353783,
            -1.2112530978214409e-09
          ],
          [
            -1.0248624171538268e-10,
            0.05883236534533176,
            -6.126845142340187e-10
          ],
          [
            -7.771561172376096e-16,
            -1.1102230246251565e-16,
            -1.1657341758564144e-15
          ]
        ]
      },
      "reflected": {
        "reached": true,
        "construction": "reflect_displacements_about_reconstructed_parent",
        "energies_eV": [
          -52.42555096972196,
          -52.491976794299454,
          -52.66880705454639,
          -52.90250367007788,
          -53.14931447042764,
          -53.394598065122565,
          -53.62617399895686,
          -53.81132241839757,
          -53.893178918351026
        ],
        "cartesian_polarizations_e_A2": [
          [
            4.1312129472542714e-19,
            7.249951129472942e-19,
            -2.4890558007206985e-17
          ],
          [
            -5.094210665776789e-12,
            -0.0010744805743806204,
            1.8451113069615276e-11
          ],
          [
            -1.0107930637535101e-11,
            -0.0019060258738559756,
            3.647724526821712e-11
          ],
          [
            -1.5202832042116673e-11,
            -0.002248152884230162,
            5.410971645724222e-11
          ],
          [
            -2.043842655123155e-11,
            -0.0020190189591827957,
            7.14923873487512e-11
          ],
          [
            -2.5603738490240297e-11,
            -0.0013495314582147003,
            8.857424830727946e-11
          ],
          [
            -3.0344017918073765e-11,
            -0.00043606834021594186,
            1.052210528311774e-10
          ],
          [
            -3.4385181267511884e-11,
            0.0005740218034041786,
            1.2132551213248107e-10
          ],
          [
            -3.780533170133058e-11,
            0.0015899347859844363,
            1.3686754619245958e-10
          ]
        ],
        "raw_reduced_polarization": [
          [
            -3.948153559288067e-16,
            3.9696555131378566e-17,
            -8.265086136831452e-16
          ],
          [
            1.0248324877013249e-10,
            -0.05883236534533221,
            6.126822821594876e-10
          ],
          [
            2.0114252045422315e-10,
            -0.10436299477353618,
            1.2112527733964308e-09
          ],
          [
            2.9007326640471174e-10,
            -0.12309589860517892,
            1.7967514719000746e-09
          ],
          [
            3.6928831635212314e-10,
            -0.11054984508609375,
            2.373955374540246e-09
          ],
          [
            4.463253695879981e-10,
            -0.0738925669647157,
            2.941170670230826e-09
          ],
          [
            5.330579904340513e-10,
            -0.02387658978563255,
            3.493939608770387e-09
          ],
          [
            6.386008639265402e-10,
            0.03143012657397578,
            4.0286995899400794e-09
          ],
          [
            7.595198009048606e-10,
            0.08705566804519424,
            4.544783842491173e-09
          ]
        ],
        "unwrapped_reduced_polarization": [
          [
            -3.948153559288067e-16,
            3.9696555131378566e-17,
            -8.265086136831452e-16
          ],
          [
            1.0248324877013249e-10,
            -0.05883236534533221,
            6.126822821594876e-10
          ],
          [
            2.0114252045422315e-10,
            -0.10436299477353618,
            1.2112527733964308e-09
          ],
          [
            2.9007326640471174e-10,
            -0.12309589860517892,
            1.7967514719000746e-09
          ],
          [
            3.6928831635212314e-10,
            -0.11054984508609375,
            2.373955374540246e-09
          ],
          [
            4.463253695879981e-10,
            -0.0738925669647157,
            2.941170670230826e-09
          ],
          [
            5.330579904340513e-10,
            -0.02387658978563255,
            3.493939608770387e-09
          ],
          [
            6.386008639265402e-10,
            0.03143012657397578,
            4.0286995899400794e-09
          ],
          [
            7.595198009048606e-10,
            0.08705566804519424,
            4.544783842491173e-09
          ]
        ],
        "gauge_integer_shift": [
          0,
          0,
          0
        ],
        "expected_opposite_endpoint_reduced_polarization": [
          7.595190360506965e-10,
          0.08705566804519624,
          4.5447823918142286e-09
        ],
        "actual_opposite_endpoint_branch_residual": 2.5851641770035194e-15
      },
      "pnp_branch": {
        "construction": "incoming_path_concatenated_with_parent_reflection",
        "reduced_polarization": [
          [
            -7.595205875123987e-10,
            -0.08705566804519649,
            -4.5447846689997865e-09
          ],
          [
            -6.386018229343476e-10,
            -0.031430126573975745,
            -4.0287001197972614e-09
          ],
          [
            -5.330583707678768e-10,
            0.023876589785632493,
            -3.4939399980182196e-09
          ],
          [
            -4.4632542390265443e-10,
            0.07389256696471576,
            -2.9411705279067282e-09
          ],
          [
            -3.6928863073911397e-10,
            0.1105498450860933,
            -2.373955532297077e-09
          ],
          [
            -2.900729241511775e-10,
            0.12309589860517905,
            -1.796751509624534e-09
          ],
          [
            -2.0114298374701447e-10,
            0.10436299477353782,
            -1.2112531026280776e-09
          ],
          [
            -1.0248623717258838e-10,
            0.05883236534533176,
            -6.126845284795788e-10
          ],
          [
            -7.757308511393068e-16,
            -1.1751946419230596e-16,
            -1.138592779015785e-15
          ],
          [
            1.0248324877013249e-10,
            -0.05883236534533221,
            6.126822821594876e-10
          ],
          [
            2.0114252045422315e-10,
            -0.10436299477353618,
            1.2112527733964308e-09
          ],
          [
            2.9007326640471174e-10,
            -0.12309589860517892,
            1.7967514719000746e-09
          ],
          [
            3.6928831635212314e-10,
            -0.11054984508609375,
            2.373955374540246e-09
          ],
          [
            4.463253695879981e-10,
            -0.0738925669647157,
            2.941170670230826e-09
          ],
          [
            5.330579904340513e-10,
            -0.02387658978563255,
            3.493939608770387e-09
          ],
          [
            6.386008639265402e-10,
            0.03143012657397578,
            4.0286995899400794e-09
          ],
          [
            7.595198009048606e-10,
            0.08705566804519424,
            4.544783842491173e-09
          ]
        ],
        "unwrapped_reduced_polarization": [
          [
            -7.595205875123987e-10,
            -0.08705566804519649,
            -4.5447846689997865e-09
          ],
          [
            -6.386018229343476e-10,
            -0.031430126573975745,
            -4.0287001197972614e-09
          ],
          [
            -5.330583707678768e-10,
            0.023876589785632493,
            -3.4939399980182196e-09
          ],
          [
            -4.4632542390265443e-10,
            0.07389256696471576,
            -2.9411705279067282e-09
          ],
          [
            -3.6928863073911397e-10,
            0.1105498450860933,
            -2.373955532297077e-09
          ],
          [
            -2.900729241511775e-10,
            0.12309589860517905,
            -1.796751509624534e-09
          ],
          [
            -2.0114298374701447e-10,
            0.10436299477353782,
            -1.2112531026280776e-09
          ],
          [
            -1.0248623717258838e-10,
            0.05883236534533176,
            -6.126845284795788e-10
          ],
          [
            -7.757308511407003e-16,
            -1.1796119636642288e-16,
            -1.1385927790538715e-15
          ],
          [
            1.0248324877013249e-10,
            -0.05883236534533221,
            6.126822821594876e-10
          ],
          [
            2.0114252045422315e-10,
            -0.10436299477353618,
            1.2112527733964308e-09
          ],
          [
            2.9007326640471174e-10,
            -0.12309589860517892,
            1.7967514719000746e-09
          ],
          [
            3.6928831635212314e-10,
            -0.11054984508609375,
            2.373955374540246e-09
          ],
          [
            4.463253695879981e-10,
            -0.0738925669647157,
            2.941170670230826e-09
          ],
          [
            5.330579904340513e-10,
            -0.02387658978563255,
            3.493939608770387e-09
          ],
          [
            6.386008639265402e-10,
            0.03143012657397578,
            4.0286995899400794e-09
          ],
          [
            7.595198009048606e-10,
            0.08705566804519424,
            4.544783842491173e-09
          ]
        ],
        "berry_integer_shifts": [
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ]
        ],
        "folded_reduced_polarization": [
          [
            -7.595206130694976e-10,
            -0.08705566804519649,
            -4.5447846597213015e-09
          ],
          [
            -6.386018380766245e-10,
            -0.03143012657397576,
            -4.028700095748405e-09
          ],
          [
            -5.330583752183315e-10,
            0.02387658978563245,
            -3.4939399706779284e-09
          ],
          [
            -4.463254210662626e-10,
            0.0738925669647158,
            -2.941170529346948e-09
          ],
          [
            -3.692886552109087e-10,
            0.11054984508609333,
            -2.37395553215336e-09
          ],
          [
            -2.9007291013627423e-10,
            0.12309589860517911,
            -1.7967515253403121e-09
          ],
          [
            -2.011429911519258e-10,
            0.10436299477353783,
            -1.2112530978214409e-09
          ],
          [
            -1.0248624171538268e-10,
            0.05883236534533176,
            -6.126845142340187e-10
          ],
          [
            -7.771561172376096e-16,
            -1.1102230246251565e-16,
            -1.1657341758564144e-15
          ],
          [
            1.0248324411321619e-10,
            -0.058832365345332205,
            6.126822382768182e-10
          ],
          [
            2.0114254706271595e-10,
            -0.10436299477353617,
            1.2112527647545335e-09
          ],
          [
            2.9007329871433285e-10,
            -0.12309589860517889,
            1.7967515253403121e-09
          ],
          [
            3.692882666328501e-10,
            -0.11054984508609378,
            2.3739553656199064e-09
          ],
          [
            4.463254210662626e-10,
            -0.07389256696471569,
            2.9411706403692506e-09
          ],
          [
            5.330580421514242e-10,
            -0.023876589785632563,
            3.4939395820998698e-09
          ],
          [
            6.386008388759024e-10,
            0.031430126573975814,
            4.028699596148044e-09
          ],
          [
            7.595197804022291e-10,
            0.08705566804519427,
            4.544783882565184e-09
          ]
        ]
      },
      "incoming_structure_ids": [
        "incoming_00_000",
        "incoming_00_001",
        "incoming_00_002",
        "incoming_00_003",
        "incoming_00_004",
        "incoming_00_005",
        "incoming_00_006",
        "incoming_00_007",
        "incoming_00_008"
      ],
      "reflected_structure_ids": [
        "reflected_00_001",
        "reflected_00_002",
        "reflected_00_003",
        "reflected_00_004",
        "reflected_00_005",
        "reflected_00_006",
        "reflected_00_007",
        "reflected_00_008"
      ]
    },
    {
      "orbit_id": 1,
      "formal_class": [
        0.0,
        0.5,
        0.0
      ],
      "formal_classes_in_orbit": [
        [
          0.0,
          0.5,
          0.0
        ]
      ],
      "target_reduced_polarization": [
        0.0,
        -0.5,
        0.0
      ],
      "bec_backprojection": {
        "converged_to_target": true,
        "history": [
          {
            "iteration": 0,
            "reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "branch_aligned_reduced_polarization": [
              -7.595203465343134e-10,
              -0.08705566804519671,
              -4.544784617557341e-09
            ],
            "target_residual": 0.41294433195480335,
            "energy_eV": -53.89317891835103,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.015537300985210912,
            "step_scale": 0.6442490154465006,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0034032467172904,
              0.995309995032361,
              0.984582780159047
            ],
            "cell_volume_ratio": 0.9833001449775232,
            "cell_rmsd_from_input_A": 0.0526349798987161
          },
          {
            "iteration": 1,
            "reduced_polarization": [
              -4.75241505214966e-10,
              -0.35933469353924957,
              -1.739518642316712e-09
            ],
            "branch_aligned_reduced_polarization": [
              -4.75241505214966e-10,
              -0.35933469353924957,
              -1.739518642316712e-09
            ],
            "target_residual": 0.14066530646075043,
            "energy_eV": -52.57760184451436,
            "max_atomic_step_A": 0.05996754243529031,
            "max_log_strain_component": 0.007356516983248343,
            "step_scale": 1.0,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0050186352387545,
              0.9930970760859472,
              0.977366256998481
            ],
            "cell_volume_ratio": 0.9754907576781751,
            "cell_rmsd_from_input_A": 0.07722243637017266
          },
          {
            "iteration": 2,
            "reduced_polarization": [
              -8.928380530268243e-11,
              -0.5036916315350445,
              -7.080524796791008e-11
            ],
            "branch_aligned_reduced_polarization": [
              -8.928380530268243e-11,
              -0.5036916315350445,
              -7.080524796791008e-11
            ],
            "target_residual": 0.0036916315350444835,
            "energy_eV": -49.75014883031676,
            "max_atomic_step_A": 0.001571735052638845,
            "max_log_strain_component": 0.00020223047388892872,
            "step_scale": 1.0,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.004974193503559,
              0.9931578433566437,
              0.9775639302268986
            ],
            "cell_volume_ratio": 0.9757046062212491,
            "cell_rmsd_from_input_A": 0.07654935171493944
          },
          {
            "iteration": 3,
            "reduced_polarization": [
              1.4574313810150962e-12,
              -0.4999244678703787,
              -9.6347952157603e-14
            ],
            "branch_aligned_reduced_polarization": [
              1.4574313810150962e-12,
              -0.4999244678703787,
              -9.6347952157603e-14
            ],
            "target_residual": 7.553212962130297e-05,
            "energy_eV": -49.85281116252259
          }
        ],
        "iterations": 3
      },
      "parent": {
        "candidate_id": "bec_projection_01",
        "source": "MACEField_BEC_backprojection",
        "spacegroup": "P2_1",
        "spacegroup_number": 4,
        "pointgroup": "2",
        "has_inversion": false,
        "is_polar_point_group": true,
        "nonpolar_parent_hypothesis": false,
        "symmetry_tolerance_A": null,
        "target_reduced_polarization": [
          0.0,
          -0.5,
          0.0
        ],
        "formal_class": [
          0.0,
          0.5,
          0.0
        ],
        "target_residual": 7.553212962130297e-05,
        "parent_symmetrization_rmsd_A": 0.16448733729397108,
        "parent_cell_rmsd_A": 0.07654935171493944,
        "energy_eV": -49.85281116252259,
        "reduced_polarization": [
          1.4574313810150962e-12,
          -0.4999244678703787,
          -9.6347952157603e-14
        ],
        "cartesian_polarization_e_A2": [
          1.0814608067279783e-12,
          -0.009147732687493495,
          -2.0846025419798317e-12
        ],
        "ranking_score": 0.6837757394819486
      },
      "branch_status": "awaiting_branch_sampling"
    },
    {
      "orbit_id": 2,
      "formal_class": [
        0.0,
        0.0,
        0.5
      ],
      "formal_classes_in_orbit": [
        [
          0.0,
          0.0,
          0.5
        ]
      ],
      "target_reduced_polarization": [
        0.0,
        0.0,
        -0.5
      ],
      "bec_backprojection": {
        "converged_to_target": false,
        "history": [
          {
            "iteration": 0,
            "reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "branch_aligned_reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.54478460421015e-09
            ],
            "target_residual": 0.5075221027640184,
            "energy_eV": -53.89317891835103,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.005013938184220933,
            "step_scale": 0.3025451872460767,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0060126096855768,
              0.9998567219968199,
              0.9958246953171824
            ],
            "cell_volume_ratio": 1.0016686628737301,
            "cell_rmsd_from_input_A": 0.026954951713607508
          },
          {
            "iteration": 1,
            "reduced_polarization": [
              -0.009355622018953687,
              -0.05958350600593799,
              -0.14480482354806104
            ],
            "branch_aligned_reduced_polarization": [
              -0.009355622018953687,
              -0.05958350600593799,
              -0.144804823548061
            ],
            "target_residual": 0.360279523739617,
            "energy_eV": -53.28594947278057,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.006004230293704444,
            "step_scale": 0.3598157168338106,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0125027909075635,
              0.999746275942615,
              0.990046442187518
            ],
            "cell_volume_ratio": 1.0021704465590786,
            "cell_rmsd_from_input_A": 0.06093203557829606
          },
          {
            "iteration": 2,
            "reduced_polarization": [
              -0.022582060675235795,
              -0.03535562632543019,
              -0.2547003486724511
            ],
            "branch_aligned_reduced_polarization": [
              -0.022582060675235795,
              -0.03535562632543019,
              -0.2547003486724511
            ],
            "target_residual": 0.2488611836318001,
            "energy_eV": -51.32833898972332,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.011278533055304171,
            "step_scale": 0.502591680544653,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.023267466794089,
              0.9999918011719803,
              0.9773256997128911
            ],
            "cell_volume_ratio": 1.0000573936121657,
            "cell_rmsd_from_input_A": 0.12753373583919692
          },
          {
            "iteration": 3,
            "reduced_polarization": [
              -0.008418259517395766,
              -0.001113897784965536,
              -0.36513758116905903
            ],
            "branch_aligned_reduced_polarization": [
              -0.008418259517395766,
              -0.001113897784965536,
              -0.36513758116905903
            ],
            "target_residual": 0.13512949298546825,
            "energy_eV": -46.32218547258222,
            "max_atomic_step_A": 0.11999999999999998,
            "max_log_strain_component": 0.00929118728585809,
            "step_scale": 0.6692451317980362,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0311722260523644,
              1.0004835688002993,
              0.9660632358575691
            ],
            "cell_volume_ratio": 0.9966592978226007,
            "cell_rmsd_from_input_A": 0.1806496848992889
          },
          {
            "iteration": 4,
            "reduced_polarization": [
              -0.0036302974011121645,
              0.007554025037288249,
              -0.45728036653773463
            ],
            "branch_aligned_reduced_polarization": [
              -0.0036302974011121645,
              0.007554025037288249,
              -0.45728036653773463
            ],
            "target_residual": 0.04353400322316801,
            "energy_eV": -43.70269181675429,
            "max_atomic_step_A": 0.04168256107530596,
            "max_log_strain_component": 0.007350777217066116,
            "step_scale": 1.0,
            "strain_jacobian_refreshed": true,
            "strain_jacobian_frobenius_norm": 2.16804376359792,
            "cell_principal_stretches": [
              1.0307404414783559,
              0.9952792747574966,
              0.9614256635786369
            ],
            "cell_volume_ratio": 0.9863021671476132,
            "cell_rmsd_from_input_A": 0.20604619027409138
          },
          {
            "iteration": 5,
            "reduced_polarization": [
              -0.0009540193289147178,
              0.0013554612484115054,
              -0.5010223212892424
            ],
            "branch_aligned_reduced_polarization": [
              -0.0009540193289147178,
              0.0013554612484115054,
              -0.5010223212892424
            ],
            "target_residual": 0.0019474518978209471,
            "energy_eV": -43.03841427554002
          }
        ],
        "iterations": 5
      },
      "parent": {
        "candidate_id": "bec_projection_02",
        "source": "MACEField_BEC_backprojection",
        "spacegroup": "P1",
        "spacegroup_number": 1,
        "pointgroup": "1",
        "has_inversion": false,
        "is_polar_point_group": true,
        "nonpolar_parent_hypothesis": false,
        "symmetry_tolerance_A": null,
        "target_reduced_polarization": [
          0.0,
          0.0,
          -0.5
        ],
        "formal_class": [
          0.0,
          0.0,
          0.5
        ],
        "target_residual": 0.0019474518978209471,
        "parent_symmetrization_rmsd_A": 0.4883632143398143,
        "parent_cell_rmsd_A": 0.20604619027409138,
        "energy_eV": -43.03841427554002,
        "reduced_polarization": [
          -0.0009540193289147178,
          0.0013554612484115054,
          -0.5010223212892424
        ],
        "cartesian_polarization_e_A2": [
          0.006236778958156369,
          0.0003471388567093781,
          -0.015155414172532975
        ],
        "ranking_score": 1.0437696657039792
      },
      "branch_status": "awaiting_branch_sampling"
    },
    {
      "orbit_id": 3,
      "formal_class": [
        0.5,
        0.0,
        0.0
      ],
      "formal_classes_in_orbit": [
        [
          0.5,
          0.0,
          0.0
        ]
      ],
      "target_reduced_polarization": [
        -0.5,
        0.0,
        0.0
      ],
      "bec_backprojection": {
        "converged_to_target": true,
        "history": [
          {
            "iteration": 0,
            "reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "branch_aligned_reduced_polarization": [
              -7.595203355137414e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "target_residual": 0.5075221064931804,
            "energy_eV": -53.89317891835103,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.002993570853891136,
            "step_scale": 0.3980840117643748,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0045755646858407,
              0.9999026342742939,
              0.9977285952230857
            ],
            "cell_volume_ratio": 1.0021961778894524,
            "cell_rmsd_from_input_A": 0.021078757218034413
          },
          {
            "iteration": 1,
            "reduced_polarization": [
              -0.18615244045640564,
              -0.052570571465777316,
              -0.007279953739117936
            ],
            "branch_aligned_reduced_polarization": [
              -0.18615244045640567,
              -0.052570571465777316,
              -0.007279953739117936
            ],
            "target_residual": 0.3183032411744374,
            "energy_eV": -53.31043246411187,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.004081598443207747,
            "step_scale": 0.5512449424347446,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0104076139325378,
              0.9995935439815817,
              0.9932412533592587
            ],
            "cell_volume_ratio": 1.003170614334705,
            "cell_rmsd_from_input_A": 0.0538350073414281
          },
          {
            "iteration": 2,
            "reduced_polarization": [
              -0.32820044714480057,
              -0.022159071591827173,
              -0.011371740649991881
            ],
            "branch_aligned_reduced_polarization": [
              -0.32820044714480057,
              -0.022159071591827173,
              -0.011371740649991881
            ],
            "target_residual": 0.17359558548669624,
            "energy_eV": -51.30105456633339,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.006541482258403632,
            "step_scale": 0.8285996131912644,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0183534718997098,
              0.9998073731424435,
              0.9833381826626634
            ],
            "cell_volume_ratio": 1.0011929585561317,
            "cell_rmsd_from_input_A": 0.1094163955494444
          },
          {
            "iteration": 3,
            "reduced_polarization": [
              -0.4593929210466552,
              0.00027134417721946954,
              0.003130629277124866
            ],
            "branch_aligned_reduced_polarization": [
              -0.4593929210466552,
              0.00027134417721946954,
              0.003130629277124866
            ],
            "target_residual": 0.04072848301197187,
            "energy_eV": -47.36802703038702,
            "max_atomic_step_A": 0.04026696682630418,
            "max_log_strain_component": 0.0020156281071714655,
            "step_scale": 1.0,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.020146870014122,
              1.0000141225711652,
              0.9801508593099888
            ],
            "cell_volume_ratio": 0.9999119523950175,
            "cell_rmsd_from_input_A": 0.12476529514041074
          },
          {
            "iteration": 4,
            "reduced_polarization": [
              -0.4997796601020415,
              0.0002065501877761135,
              0.000618038311071996
            ],
            "branch_aligned_reduced_polarization": [
              -0.4997796601020415,
              0.0002065501877761135,
              0.000618038311071996
            ],
            "target_residual": 0.0006878837144862748,
            "energy_eV": -46.20158536052306
          }
        ],
        "iterations": 4
      },
      "parent": {
        "candidate_id": "bec_projection_03",
        "source": "MACEField_BEC_backprojection",
        "spacegroup": "P1",
        "spacegroup_number": 1,
        "pointgroup": "1",
        "has_inversion": false,
        "is_polar_point_group": true,
        "nonpolar_parent_hypothesis": false,
        "symmetry_tolerance_A": null,
        "target_reduced_polarization": [
          -0.5,
          0.0,
          0.0
        ],
        "formal_class": [
          0.5,
          0.0,
          0.0
        ],
        "target_residual": 0.0006878837144862748,
        "parent_symmetrization_rmsd_A": 0.36918562335139327,
        "parent_cell_rmsd_A": 0.12476529514041074,
        "energy_eV": -46.20158536052306,
        "reduced_polarization": [
          -0.4997796601020415,
          0.0002065501877761135,
          0.000618038311071996
        ],
        "cartesian_polarization_e_A2": [
          -0.012591566739529445,
          0.000160917314013794,
          1.954715929042635e-05
        ],
        "ranking_score": 0.9017527145654685
      },
      "branch_status": "awaiting_branch_sampling"
    },
    {
      "orbit_id": 4,
      "formal_class": [
        0.0,
        0.5,
        0.5
      ],
      "formal_classes_in_orbit": [
        [
          0.0,
          0.5,
          0.5
        ]
      ],
      "target_reduced_polarization": [
        0.0,
        -0.5,
        -0.5
      ],
      "bec_backprojection": {
        "converged_to_target": false,
        "history": [
          {
            "iteration": 0,
            "reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "branch_aligned_reduced_polarization": [
              -7.595203465343134e-10,
              -0.08705566804519671,
              -4.54478460421015e-09
            ],
            "target_residual": 0.6484774604786309,
            "energy_eV": -53.89317891835103,
            "max_atomic_step_A": 0.12000000000000001,
            "max_log_strain_component": 0.006340375735439766,
            "step_scale": 0.2629015700170476,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0022621650692993,
              0.9997546149668756,
              0.9911528443950072
            ],
            "cell_volume_ratio": 0.9931512314739994,
            "cell_rmsd_from_input_A": 0.03127636295805091
          },
          {
            "iteration": 1,
            "reduced_polarization": [
              -0.00033524568858356025,
              -0.19032826086037918,
              -0.12311245989945088
            ],
            "branch_aligned_reduced_polarization": [
              -0.00033524568858356025,
              -0.19032826086037918,
              -0.12311245989945085
            ],
            "target_residual": 0.4877918780529993,
            "energy_eV": -53.380916891458696,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.008325890233352621,
            "step_scale": 0.33897884618908514,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.005312123376987,
              0.9997264902153632,
              0.9792960591451196
            ],
            "cell_volume_ratio": 0.9842289307430647,
            "cell_rmsd_from_input_A": 0.07344369564724039
          },
          {
            "iteration": 2,
            "reduced_polarization": [
              -0.00555528585429904,
              -0.2795381852838004,
              -0.2240770212255951
            ],
            "branch_aligned_reduced_polarization": [
              -0.00555528585429904,
              -0.2795381852838004,
              -0.22407702122559514
            ],
            "target_residual": 0.35322480542088713,
            "energy_eV": -51.199695603925385,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.010063902628571224,
            "step_scale": 0.3223485350655371,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0099813465432301,
              1.0010220916559318,
              0.9629455173236533
            ],
            "cell_volume_ratio": 0.9735510526393891,
            "cell_rmsd_from_input_A": 0.13429626171168474
          },
          {
            "iteration": 3,
            "reduced_polarization": [
              -0.005343759316257905,
              -0.3405215705375067,
              -0.3116355954098325
            ],
            "branch_aligned_reduced_polarization": [
              -0.005343759316257905,
              -0.3405215705375067,
              -0.3116355954098325
            ],
            "target_residual": 0.246866510778724,
            "energy_eV": -47.499874056506016,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.009766372068276517,
            "step_scale": 0.46439616532436945,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0146225392190016,
              1.0022681834673604,
              0.9472681645221767
            ],
            "cell_volume_ratio": 0.9632996260646631,
            "cell_rmsd_from_input_A": 0.19229849632362064
          },
          {
            "iteration": 4,
            "reduced_polarization": [
              -0.006615263068372976,
              -0.40556828960600627,
              -0.4076522641627462
            ],
            "branch_aligned_reduced_polarization": [
              -0.006615263068372976,
              -0.40556828960600627,
              -0.4076522641627462
            ],
            "target_residual": 0.1322467918237191,
            "energy_eV": -42.88783498725076,
            "max_atomic_step_A": 0.11039886370316483,
            "max_log_strain_component": 0.010792524899373893,
            "step_scale": 1.0,
            "strain_jacobian_refreshed": true,
            "strain_jacobian_frobenius_norm": 2.6189498739019874,
            "cell_principal_stretches": [
              1.015329682138917,
              0.9856927783499042,
              0.9343571723154286
            ],
            "cell_volume_ratio": 0.9351075875700782,
            "cell_rmsd_from_input_A": 0.30661889933789144
          },
          {
            "iteration": 5,
            "reduced_polarization": [
              -0.015078162153656975,
              -0.4834344418809933,
              -0.5060056074717825
            ],
            "branch_aligned_reduced_polarization": [
              -0.015078162153656975,
              -0.4834344418809933,
              -0.5060056074717825
            ],
            "target_residual": 0.02319129170251823,
            "energy_eV": -34.216318448556194
          }
        ],
        "iterations": 5
      },
      "parent": {
        "candidate_id": "bec_projection_04",
        "source": "MACEField_BEC_backprojection",
        "spacegroup": "P1",
        "spacegroup_number": 1,
        "pointgroup": "1",
        "has_inversion": false,
        "is_polar_point_group": true,
        "nonpolar_parent_hypothesis": false,
        "symmetry_tolerance_A": null,
        "target_reduced_polarization": [
          0.0,
          -0.5,
          -0.5
        ],
        "formal_class": [
          0.0,
          0.5,
          0.5
        ],
        "target_residual": 0.02319129170251823,
        "parent_symmetrization_rmsd_A": 0.5623364825369662,
        "parent_cell_rmsd_A": 0.30661889933789144,
        "energy_eV": -34.216318448556194,
        "reduced_polarization": [
          -0.015078162153656975,
          -0.4834344418809933,
          -0.5060056074717825
        ],
        "cartesian_polarization_e_A2": [
          0.005681710611547351,
          -0.008803047172018168,
          -0.0160195233860842
        ],
        "ranking_score": 1.1853737907764756
      },
      "branch_status": "awaiting_branch_sampling"
    },
    {
      "orbit_id": 5,
      "formal_class": [
        0.5,
        0.5,
        0.0
      ],
      "formal_classes_in_orbit": [
        [
          0.5,
          0.5,
          0.0
        ]
      ],
      "target_reduced_polarization": [
        -0.5,
        -0.5,
        0.0
      ],
      "bec_backprojection": {
        "converged_to_target": true,
        "history": [
          {
            "iteration": 0,
            "reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "branch_aligned_reduced_polarization": [
              -7.595203355137414e-10,
              -0.08705566804519671,
              -4.544784617557341e-09
            ],
            "target_residual": 0.6484774633972089,
            "energy_eV": -53.89317891835103,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.007868058870233402,
            "step_scale": 0.326246442500364,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0019558690054566,
              0.9983741228752683,
              0.9911841476137423
            ],
            "cell_volume_ratio": 0.991508078366517,
            "cell_rmsd_from_input_A": 0.031208330363521764
          },
          {
            "iteration": 1,
            "reduced_polarization": [
              -0.1506806536987688,
              -0.2177460524107983,
              0.0009465254097885189
            ],
            "branch_aligned_reduced_polarization": [
              -0.15068065369876882,
              -0.2177460524107983,
              0.0009465254097885189
            ],
            "target_residual": 0.44910153923178514,
            "energy_eV": -53.349781948183185,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.00876653036006371,
            "step_scale": 0.4241701201567683,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.004243440817992,
              0.9971289017130948,
              0.9807973119698423
            ],
            "cell_volume_ratio": 0.9821313524525654,
            "cell_rmsd_from_input_A": 0.06859237396173615
          },
          {
            "iteration": 2,
            "reduced_polarization": [
              -0.2649599842440401,
              -0.3290055130762424,
              0.0007316304159469488
            ],
            "branch_aligned_reduced_polarization": [
              -0.2649599842440401,
              -0.3290055130762424,
              0.0007316304159469488
            ],
            "target_residual": 0.29066038403598543,
            "energy_eV": -51.22661794259085,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.009358827714132914,
            "step_scale": 0.4232201409563704,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.007037669021791,
              0.9975530450919663,
              0.967792753143609
            ],
            "cell_volume_ratio": 0.9722189467723524,
            "cell_rmsd_from_input_A": 0.11776895842137586
          },
          {
            "iteration": 3,
            "reduced_polarization": [
              -0.36663428659167535,
              -0.39978923001941125,
              0.0007699009950860441
            ],
            "branch_aligned_reduced_polarization": [
              -0.36663428659167535,
              -0.39978923001941125,
              0.0007699009950860441
            ],
            "target_residual": 0.16682087603341522,
            "energy_eV": -48.26266789483389,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.009343185010447267,
            "step_scale": 0.7865455289461853,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0098561926081577,
              0.9983094213356016,
              0.9546435585380363
            ],
            "cell_volume_ratio": 0.9624229023813868,
            "cell_rmsd_from_input_A": 0.16750022636335749
          },
          {
            "iteration": 4,
            "reduced_polarization": [
              -0.48434895668274847,
              -0.48629395853825513,
              -0.005448054657176241
            ],
            "branch_aligned_reduced_polarization": [
              -0.48434895668274847,
              -0.48629395853825513,
              -0.005448054657176241
            ],
            "target_residual": 0.021505627845220726,
            "energy_eV": -44.57370891467835,
            "max_atomic_step_A": 0.01285296892323012,
            "max_log_strain_component": 0.0020612959996850074,
            "step_scale": 1.0,
            "strain_jacobian_refreshed": true,
            "strain_jacobian_frobenius_norm": 2.591071955473747,
            "cell_principal_stretches": [
              1.0098387280867014,
              0.99759477865677,
              0.9517297459152623
            ],
            "cell_volume_ratio": 0.9587819133633819,
            "cell_rmsd_from_input_A": 0.18629079384506456
          },
          {
            "iteration": 5,
            "reduced_polarization": [
              -0.5000828671213162,
              -0.5001886499086089,
              -0.0002157070324617544
            ],
            "branch_aligned_reduced_polarization": [
              -0.5000828671213162,
              -0.5001886499086089,
              -0.0002157070324617544
            ],
            "target_residual": 0.0002983039920397284,
            "energy_eV": -44.02179407002628
          }
        ],
        "iterations": 5
      },
      "parent": {
        "candidate_id": "bec_projection_05",
        "source": "MACEField_BEC_backprojection",
        "spacegroup": "P1",
        "spacegroup_number": 1,
        "pointgroup": "1",
        "has_inversion": false,
        "is_polar_point_group": true,
        "nonpolar_parent_hypothesis": false,
        "symmetry_tolerance_A": null,
        "target_reduced_polarization": [
          -0.5,
          -0.5,
          0.0
        ],
        "formal_class": [
          0.5,
          0.5,
          0.0
        ],
        "target_residual": 0.0002983039920397284,
        "parent_symmetrization_rmsd_A": 0.47616269180360915,
        "parent_cell_rmsd_A": 0.18629079384506456,
        "energy_eV": -44.02179407002628,
        "reduced_polarization": [
          -0.5000828671213162,
          -0.5001886499086089,
          -0.0002157070324617544
        ],
        "cartesian_polarization_e_A2": [
          -0.012919468661611403,
          -0.009014283889088577,
          -0.0002980910051978305
        ],
        "ranking_score": 1.0233319982489548
      },
      "branch_status": "awaiting_branch_sampling"
    },
    {
      "orbit_id": 6,
      "formal_class": [
        0.5,
        0.0,
        0.5
      ],
      "formal_classes_in_orbit": [
        [
          0.5,
          0.0,
          0.5
        ]
      ],
      "target_reduced_polarization": [
        -0.5,
        0.0,
        -0.5
      ],
      "bec_backprojection": {
        "converged_to_target": false,
        "history": [
          {
            "iteration": 0,
            "reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "branch_aligned_reduced_polarization": [
              -7.595203355137414e-10,
              -0.0870556680451967,
              -4.54478460421015e-09
            ],
            "target_residual": 0.7124455656641359,
            "energy_eV": -53.89317891835103,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.0031764163561090316,
            "step_scale": 0.23914305633017457,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0041149649958676,
              1.000199157375764,
              0.9970166742762495
            ],
            "cell_volume_ratio": 1.0013187432963526,
            "cell_rmsd_from_input_A": 0.01484849501853759
          },
          {
            "iteration": 1,
            "reduced_polarization": [
              -0.12156373867293445,
              -0.05898955859369038,
              -0.12009721808747435
            ],
            "branch_aligned_reduced_polarization": [
              -0.12156373867293446,
              -0.05898955859369038,
              -0.12009721808747437
            ],
            "target_residual": 0.5394625989029838,
            "energy_eV": -53.08997657827966,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.003056560714510463,
            "step_scale": 0.3008186629546864,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.006897200431187,
              1.0000319055068476,
              0.9933452205280707
            ],
            "cell_volume_ratio": 1.0002284333883842,
            "cell_rmsd_from_input_A": 0.027926862136999235
          },
          {
            "iteration": 2,
            "reduced_polarization": [
              -0.23024864235740344,
              -0.03090661695486916,
              -0.22676880153519852
            ],
            "branch_aligned_reduced_polarization": [
              -0.23024864235740344,
              -0.03090661695486916,
              -0.22676880153519852
            ],
            "target_residual": 0.3851964456431689,
            "energy_eV": -49.63167832778099,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.0036248268871246245,
            "step_scale": 0.37508775837441316,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0096827621538307,
              0.9997006212379337,
              0.9883936827518908
            ],
            "cell_volume_ratio": 0.9976652944503499,
            "cell_rmsd_from_input_A": 0.04462974650059137
          },
          {
            "iteration": 3,
            "reduced_polarization": [
              -0.33612617368213055,
              -0.012785557647570046,
              -0.32498320918064827
            ],
            "branch_aligned_reduced_polarization": [
              -0.33612617368213055,
              -0.012785557647570046,
              -0.32498320918064827
            ],
            "target_residual": 0.24010201687016977,
            "energy_eV": -41.685859327811244,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.005305822300131532,
            "step_scale": 0.6612992708372067,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0130720931819408,
              0.9994255809723709,
              0.9809717859225721
            ],
            "cell_volume_ratio": 0.9932242856787282,
            "cell_rmsd_from_input_A": 0.07150130711351947
          },
          {
            "iteration": 4,
            "reduced_polarization": [
              -0.3593726078255934,
              0.06495608620857424,
              -0.36087123396897897
            ],
            "branch_aligned_reduced_polarization": [
              -0.3593726078255934,
              0.06495608620857424,
              -0.36087123396897897
            ],
            "target_residual": 0.20821183948715472,
            "energy_eV": -21.226087257007958,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.009220568283948202,
            "step_scale": 0.9086420355092052,
            "strain_jacobian_refreshed": true,
            "strain_jacobian_frobenius_norm": 2.124204116225165,
            "cell_principal_stretches": [
              1.0151948151524388,
              0.9883636627432432,
              0.9745906545181193
            ],
            "cell_volume_ratio": 0.9778863945029248,
            "cell_rmsd_from_input_A": 0.13880638905767664
          },
          {
            "iteration": 5,
            "reduced_polarization": [
              -0.4166225431820463,
              0.00038842341000316173,
              -0.4472114194748633
            ],
            "branch_aligned_reduced_polarization": [
              -0.4166225431820463,
              0.00038842341000316173,
              -0.4472114194748633
            ],
            "target_residual": 0.09868427135077816,
            "energy_eV": -37.91031792483793
          }
        ],
        "iterations": 5
      },
      "parent": {
        "candidate_id": "bec_projection_06",
        "source": "MACEField_BEC_backprojection",
        "spacegroup": "P1",
        "spacegroup_number": 1,
        "pointgroup": "1",
        "has_inversion": false,
        "is_polar_point_group": true,
        "nonpolar_parent_hypothesis": false,
        "symmetry_tolerance_A": null,
        "target_reduced_polarization": [
          -0.5,
          0.0,
          -0.5
        ],
        "formal_class": [
          0.5,
          0.0,
          0.5
        ],
        "target_residual": 0.09868427135077816,
        "parent_symmetrization_rmsd_A": 0.46435619589240024,
        "parent_cell_rmsd_A": 0.13880638905767664,
        "energy_eV": -37.91031792483793,
        "reduced_polarization": [
          -0.4166225431820463,
          0.00038842341000316173,
          -0.4472114194748633
        ],
        "cartesian_polarization_e_A2": [
          -0.005045886318001597,
          -0.00017128437020789153,
          -0.013678747512121595
        ],
        "ranking_score": 1.1964263358583758
      },
      "branch_status": "awaiting_branch_sampling"
    },
    {
      "orbit_id": 7,
      "formal_class": [
        0.5,
        0.5,
        0.5
      ],
      "formal_classes_in_orbit": [
        [
          0.5,
          0.5,
          0.5
        ]
      ],
      "target_reduced_polarization": [
        -0.5,
        -0.5,
        -0.5
      ],
      "bec_backprojection": {
        "converged_to_target": false,
        "history": [
          {
            "iteration": 0,
            "reduced_polarization": [
              -7.595203465343134e-10,
              -0.0870556680451967,
              -4.544784617557341e-09
            ],
            "branch_aligned_reduced_polarization": [
              -7.595203355137414e-10,
              -0.08705566804519671,
              -4.54478460421015e-09
            ],
            "target_residual": 0.8188546977268274,
            "energy_eV": -53.89317891835103,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.005163891845679969,
            "step_scale": 0.21411905667655343,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0021868573804704,
              0.9988200718237413,
              0.9934207549784209
            ],
            "cell_volume_ratio": 0.9944184959906918,
            "cell_rmsd_from_input_A": 0.021672703103943456
          },
          {
            "iteration": 1,
            "reduced_polarization": [
              -0.10267350525589763,
              -0.16630020429277742,
              -0.10282126353051758
            ],
            "branch_aligned_reduced_polarization": [
              -0.10267350525589763,
              -0.16630020429277742,
              -0.10282126353051757
            ],
            "target_residual": 0.6534331226561536,
            "energy_eV": -53.282754870558115,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.008571927211342537,
            "step_scale": 0.27688387605496834,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0049796417938053,
              0.9966697252120243,
              0.9836160052358618
            ],
            "cell_volume_ratio": 0.985222037150999,
            "cell_rmsd_from_input_A": 0.05408177099870243
          },
          {
            "iteration": 2,
            "reduced_polarization": [
              -0.20240854246844625,
              -0.23354832903113967,
              -0.20241876330846084
            ],
            "branch_aligned_reduced_polarization": [
              -0.20240854246844625,
              -0.23354832903113965,
              -0.20241876330846087
            ],
            "target_residual": 0.4981081820134239,
            "energy_eV": -50.22221183724621,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.01244744950394016,
            "step_scale": 0.3575878978291306,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.00851269656943,
              0.9935216881890048,
              0.9700988480670893
            ],
            "cell_volume_ratio": 0.9720189034608614,
            "cell_rmsd_from_input_A": 0.09894896842661194
          },
          {
            "iteration": 3,
            "reduced_polarization": [
              -0.30419007224099054,
              -0.31862161200672917,
              -0.2952951163927323
            ],
            "branch_aligned_reduced_polarization": [
              -0.30419007224099054,
              -0.31862161200672917,
              -0.2952951163927323
            ],
            "target_residual": 0.3363684539499669,
            "energy_eV": -42.32980296480724,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.010055840625197588,
            "step_scale": 0.43611775916126433,
            "strain_jacobian_refreshed": false,
            "strain_jacobian_frobenius_norm": 1.5025458588668794,
            "cell_principal_stretches": [
              1.0118808364947187,
              0.9916639144524931,
              0.9581802810676431
            ],
            "cell_volume_ratio": 0.9614818936682992,
            "cell_rmsd_from_input_A": 0.1382032395689383
          },
          {
            "iteration": 4,
            "reduced_polarization": [
              -0.39188498349480955,
              -0.3846114120922003,
              -0.38129292741427745
            ],
            "branch_aligned_reduced_polarization": [
              -0.39188498349480955,
              -0.3846114120922003,
              -0.38129292741427745
            ],
            "target_residual": 0.19772392898975485,
            "energy_eV": -35.09713016238005,
            "max_atomic_step_A": 0.12,
            "max_log_strain_component": 0.012189940487670836,
            "step_scale": 0.802573685704941,
            "strain_jacobian_refreshed": true,
            "strain_jacobian_frobenius_norm": 2.1040445076725343,
            "cell_principal_stretches": [
              0.9949805998188249,
              0.98540246106599,
              0.9571707538193066
            ],
            "cell_volume_ratio": 0.9384641261714005,
            "cell_rmsd_from_input_A": 0.15879355068009987
          },
          {
            "iteration": 5,
            "reduced_polarization": [
              -0.4835805154466952,
              -0.47805407723031523,
              -0.47957947247436516
            ],
            "branch_aligned_reduced_polarization": [
              -0.4835805154466952,
              -0.47805407723031523,
              -0.47957947247436516
            ],
            "target_residual": 0.034179247265473715,
            "energy_eV": -30.782539114026793
          }
        ],
        "iterations": 5
      },
      "parent": {
        "candidate_id": "bec_projection_07",
        "source": "MACEField_BEC_backprojection",
        "spacegroup": "P1",
        "spacegroup_number": 1,
        "pointgroup": "1",
        "has_inversion": false,
        "is_polar_point_group": true,
        "nonpolar_parent_hypothesis": false,
        "symmetry_tolerance_A": null,
        "target_reduced_polarization": [
          -0.5,
          -0.5,
          -0.5
        ],
        "formal_class": [
          0.5,
          0.5,
          0.5
        ],
        "target_residual": 0.034179247265473715,
        "parent_symmetrization_rmsd_A": 0.6234852121051465,
        "parent_cell_rmsd_A": 0.15879355068009987,
        "energy_eV": -30.782539114026793,
        "reduced_polarization": [
          -0.4835805154466952,
          -0.47805407723031523,
          -0.47957947247436516
        ],
        "cartesian_polarization_e_A2": [
          -0.006625443730564274,
          -0.008970310628475168,
          -0.015278120086871422
        ],
        "ranking_score": 1.231542094306119
      },
      "branch_status": "awaiting_branch_sampling"
    }
  ],
  "sampled_polarization_branches": [
    {
      "orbit_id": 0,
      "candidate_id": "inversion_parent_endpoint_00",
      "formal_class": [
        0.0,
        0.0,
        0.0
      ],
      "construction": "MACEField-BEC-parent plus variable-cell P-N-P path and symmetric log-strain continuation beyond both polar endpoints",
      "geometry_diagnostics": {
        "collision_aware": false,
        "permutations_tested": 1,
        "selected_order": [
          0,
          1,
          2,
          3,
          4,
          5,
          6,
          7,
          8,
          9,
          10,
          11
        ],
        "endpoint_rmsd_A": 0.30584634084927315,
        "minimum_distance_A_by_image": [
          1.799195848071681,
          1.7942217998239807,
          1.7898997771276348,
          1.7862345129663757,
          1.7832300570637594,
          1.7808897538791464,
          1.7792162242067595,
          1.7782113506110873,
          1.7778762668859653
        ],
        "minimum_distance_A": 1.7778762668859653,
        "minimum_distance_floor_A": 0.0,
        "geometry_valid": true,
        "parameters": [
          0.0,
          0.125,
          0.25,
          0.375,
          0.5,
          0.625,
          0.75,
          0.875,
          1.0
        ],
        "cell_mode": "variable_cell",
        "cell_volume_A3_by_image": [
          268.7402074887097,
          268.7402074887097,
          268.7402074887097,
          268.7402074887097,
          268.7402074887097,
          268.7402074887097,
          268.7402074887097,
          268.7402074887097,
          268.7402074887097
        ],
        "cell_deformation_log_strain_norm": 0.0
      },
      "parent_reduced_polarization": [
        -7.757308511393068e-16,
        -1.1751946419230596e-16,
        -1.138592779015785e-15
      ],
      "incoming": {
        "reached": true,
        "construction": "variable_cell_linear_interpolation",
        "continuation_fractions": [
          0.0,
          0.125,
          0.25,
          0.375,
          0.5,
          0.625,
          0.75,
          0.875,
          1.0
        ],
        "energies_eV": [
          -53.89317891835103,
          -53.811322418397566,
          -53.62617399895686,
          -53.39459806512255,
          -53.149314470427626,
          -52.902503670077884,
          -52.6688070545464,
          -52.49197679429941,
          -52.42555096972195
        ],
        "cartesian_polarizations_e_A2": [
          [
            3.780532225118096e-11,
            -0.001589934785984477,
            -1.3686757108301757e-10
          ],
          [
            3.438516376149702e-11,
            -0.0005740218034041779,
            -1.2132552808929108e-10
          ],
          [
            3.034401321881904e-11,
            0.0004360683402159409,
            -1.0522106455349412e-10
          ],
          [
            2.5603735340190423e-11,
            0.0013495314582147012,
            -8.857424402114602e-11
          ],
          [
            2.043842061261294e-11,
            0.0020190189591827875,
            -7.14923920996461e-11
          ],
          [
            1.5202841130785157e-11,
            0.0022481528842301646,
            -5.410971759332578e-11
          ],
          [
            1.0107923098071473e-11,
            0.0019060258738560053,
            -3.647725518312819e-11
          ],
          [
            5.0941635699491906e-12,
            0.0010744805743806121,
            -1.8451180718227288e-11
          ],
          [
            -5.2672965077491955e-18,
            -2.1463080847601883e-18,
            -3.428906746221045e-17
          ]
        ],
        "raw_reduced_polarization": [
          [
            -7.595205875123987e-10,
            -0.08705566804519649,
            -4.5447846689997865e-09
          ],
          [
            -6.386018229343476e-10,
            -0.031430126573975745,
            -4.0287001197972614e-09
          ],
          [
            -5.330583707678768e-10,
            0.023876589785632493,
            -3.4939399980182196e-09
          ],
          [
            -4.4632542390265443e-10,
            0.07389256696471576,
            -2.9411705279067282e-09
          ],
          [
            -3.6928863073911397e-10,
            0.1105498450860933,
            -2.373955532297077e-09
          ],
          [
            -2.900729241511775e-10,
            0.12309589860517905,
            -1.796751509624534e-09
          ],
          [
            -2.0114298374701447e-10,
            0.10436299477353782,
            -1.2112531026280776e-09
          ],
          [
            -1.0248623717258838e-10,
            0.05883236534533176,
            -6.126845284795788e-10
          ],
          [
            -7.757308511393068e-16,
            -1.1751946419230596e-16,
            -1.138592779015785e-15
          ]
        ],
        "unwrapped_reduced_polarization": [
          [
            -7.595205875123987e-10,
            -0.08705566804519649,
            -4.5447846689997865e-09
          ],
          [
            -6.386018229343476e-10,
            -0.031430126573975745,
            -4.0287001197972614e-09
          ],
          [
            -5.330583707678768e-10,
            0.023876589785632493,
            -3.4939399980182196e-09
          ],
          [
            -4.4632542390265443e-10,
            0.07389256696471576,
            -2.9411705279067282e-09
          ],
          [
            -3.6928863073911397e-10,
            0.1105498450860933,
            -2.373955532297077e-09
          ],
          [
            -2.900729241511775e-10,
            0.12309589860517905,
            -1.796751509624534e-09
          ],
          [
            -2.0114298374701447e-10,
            0.10436299477353782,
            -1.2112531026280776e-09
          ],
          [
            -1.0248623717258838e-10,
            0.05883236534533176,
            -6.126845284795788e-10
          ],
          [
            -7.757308511407003e-16,
            -1.1796119636642288e-16,
            -1.1385927790538715e-15
          ]
        ],
        "berry_integer_shifts": [
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ]
        ],
        "folded_reduced_polarization": [
          [
            -7.595206130694976e-10,
            -0.08705566804519649,
            -4.5447846597213015e-09
          ],
          [
            -6.386018380766245e-10,
            -0.03143012657397576,
            -4.028700095748405e-09
          ],
          [
            -5.330583752183315e-10,
            0.02387658978563245,
            -3.4939399706779284e-09
          ],
          [
            -4.463254210662626e-10,
            0.0738925669647158,
            -2.941170529346948e-09
          ],
          [
            -3.692886552109087e-10,
            0.11054984508609333,
            -2.37395553215336e-09
          ],
          [
            -2.9007291013627423e-10,
            0.12309589860517911,
            -1.7967515253403121e-09
          ],
          [
            -2.011429911519258e-10,
            0.10436299477353783,
            -1.2112530978214409e-09
          ],
          [
            -1.0248624171538268e-10,
            0.05883236534533176,
            -6.126845142340187e-10
          ],
          [
            -7.771561172376096e-16,
            -1.1102230246251565e-16,
            -1.1657341758564144e-15
          ]
        ]
      },
      "reflected": {
        "reached": true,
        "construction": "reflect_displacements_about_reconstructed_parent",
        "energies_eV": [
          -52.42555096972196,
          -52.491976794299454,
          -52.66880705454639,
          -52.90250367007788,
          -53.14931447042764,
          -53.394598065122565,
          -53.62617399895686,
          -53.81132241839757,
          -53.893178918351026
        ],
        "cartesian_polarizations_e_A2": [
          [
            4.1312129472542714e-19,
            7.249951129472942e-19,
            -2.4890558007206985e-17
          ],
          [
            -5.094210665776789e-12,
            -0.0010744805743806204,
            1.8451113069615276e-11
          ],
          [
            -1.0107930637535101e-11,
            -0.0019060258738559756,
            3.647724526821712e-11
          ],
          [
            -1.5202832042116673e-11,
            -0.002248152884230162,
            5.410971645724222e-11
          ],
          [
            -2.043842655123155e-11,
            -0.0020190189591827957,
            7.14923873487512e-11
          ],
          [
            -2.5603738490240297e-11,
            -0.0013495314582147003,
            8.857424830727946e-11
          ],
          [
            -3.0344017918073765e-11,
            -0.00043606834021594186,
            1.052210528311774e-10
          ],
          [
            -3.4385181267511884e-11,
            0.0005740218034041786,
            1.2132551213248107e-10
          ],
          [
            -3.780533170133058e-11,
            0.0015899347859844363,
            1.3686754619245958e-10
          ]
        ],
        "raw_reduced_polarization": [
          [
            -3.948153559288067e-16,
            3.9696555131378566e-17,
            -8.265086136831452e-16
          ],
          [
            1.0248324877013249e-10,
            -0.05883236534533221,
            6.126822821594876e-10
          ],
          [
            2.0114252045422315e-10,
            -0.10436299477353618,
            1.2112527733964308e-09
          ],
          [
            2.9007326640471174e-10,
            -0.12309589860517892,
            1.7967514719000746e-09
          ],
          [
            3.6928831635212314e-10,
            -0.11054984508609375,
            2.373955374540246e-09
          ],
          [
            4.463253695879981e-10,
            -0.0738925669647157,
            2.941170670230826e-09
          ],
          [
            5.330579904340513e-10,
            -0.02387658978563255,
            3.493939608770387e-09
          ],
          [
            6.386008639265402e-10,
            0.03143012657397578,
            4.0286995899400794e-09
          ],
          [
            7.595198009048606e-10,
            0.08705566804519424,
            4.544783842491173e-09
          ]
        ],
        "unwrapped_reduced_polarization": [
          [
            -3.948153559288067e-16,
            3.9696555131378566e-17,
            -8.265086136831452e-16
          ],
          [
            1.0248324877013249e-10,
            -0.05883236534533221,
            6.126822821594876e-10
          ],
          [
            2.0114252045422315e-10,
            -0.10436299477353618,
            1.2112527733964308e-09
          ],
          [
            2.9007326640471174e-10,
            -0.12309589860517892,
            1.7967514719000746e-09
          ],
          [
            3.6928831635212314e-10,
            -0.11054984508609375,
            2.373955374540246e-09
          ],
          [
            4.463253695879981e-10,
            -0.0738925669647157,
            2.941170670230826e-09
          ],
          [
            5.330579904340513e-10,
            -0.02387658978563255,
            3.493939608770387e-09
          ],
          [
            6.386008639265402e-10,
            0.03143012657397578,
            4.0286995899400794e-09
          ],
          [
            7.595198009048606e-10,
            0.08705566804519424,
            4.544783842491173e-09
          ]
        ],
        "gauge_integer_shift": [
          0,
          0,
          0
        ],
        "expected_opposite_endpoint_reduced_polarization": [
          7.595190360506965e-10,
          0.08705566804519624,
          4.5447823918142286e-09
        ],
        "actual_opposite_endpoint_branch_residual": 2.5851641770035194e-15
      },
      "pnp_branch": {
        "construction": "incoming_path_concatenated_with_parent_reflection",
        "reduced_polarization": [
          [
            -7.595205875123987e-10,
            -0.08705566804519649,
            -4.5447846689997865e-09
          ],
          [
            -6.386018229343476e-10,
            -0.031430126573975745,
            -4.0287001197972614e-09
          ],
          [
            -5.330583707678768e-10,
            0.023876589785632493,
            -3.4939399980182196e-09
          ],
          [
            -4.4632542390265443e-10,
            0.07389256696471576,
            -2.9411705279067282e-09
          ],
          [
            -3.6928863073911397e-10,
            0.1105498450860933,
            -2.373955532297077e-09
          ],
          [
            -2.900729241511775e-10,
            0.12309589860517905,
            -1.796751509624534e-09
          ],
          [
            -2.0114298374701447e-10,
            0.10436299477353782,
            -1.2112531026280776e-09
          ],
          [
            -1.0248623717258838e-10,
            0.05883236534533176,
            -6.126845284795788e-10
          ],
          [
            -7.757308511393068e-16,
            -1.1751946419230596e-16,
            -1.138592779015785e-15
          ],
          [
            1.0248324877013249e-10,
            -0.05883236534533221,
            6.126822821594876e-10
          ],
          [
            2.0114252045422315e-10,
            -0.10436299477353618,
            1.2112527733964308e-09
          ],
          [
            2.9007326640471174e-10,
            -0.12309589860517892,
            1.7967514719000746e-09
          ],
          [
            3.6928831635212314e-10,
            -0.11054984508609375,
            2.373955374540246e-09
          ],
          [
            4.463253695879981e-10,
            -0.0738925669647157,
            2.941170670230826e-09
          ],
          [
            5.330579904340513e-10,
            -0.02387658978563255,
            3.493939608770387e-09
          ],
          [
            6.386008639265402e-10,
            0.03143012657397578,
            4.0286995899400794e-09
          ],
          [
            7.595198009048606e-10,
            0.08705566804519424,
            4.544783842491173e-09
          ]
        ],
        "unwrapped_reduced_polarization": [
          [
            -7.595205875123987e-10,
            -0.08705566804519649,
            -4.5447846689997865e-09
          ],
          [
            -6.386018229343476e-10,
            -0.031430126573975745,
            -4.0287001197972614e-09
          ],
          [
            -5.330583707678768e-10,
            0.023876589785632493,
            -3.4939399980182196e-09
          ],
          [
            -4.4632542390265443e-10,
            0.07389256696471576,
            -2.9411705279067282e-09
          ],
          [
            -3.6928863073911397e-10,
            0.1105498450860933,
            -2.373955532297077e-09
          ],
          [
            -2.900729241511775e-10,
            0.12309589860517905,
            -1.796751509624534e-09
          ],
          [
            -2.0114298374701447e-10,
            0.10436299477353782,
            -1.2112531026280776e-09
          ],
          [
            -1.0248623717258838e-10,
            0.05883236534533176,
            -6.126845284795788e-10
          ],
          [
            -7.757308511407003e-16,
            -1.1796119636642288e-16,
            -1.1385927790538715e-15
          ],
          [
            1.0248324877013249e-10,
            -0.05883236534533221,
            6.126822821594876e-10
          ],
          [
            2.0114252045422315e-10,
            -0.10436299477353618,
            1.2112527733964308e-09
          ],
          [
            2.9007326640471174e-10,
            -0.12309589860517892,
            1.7967514719000746e-09
          ],
          [
            3.6928831635212314e-10,
            -0.11054984508609375,
            2.373955374540246e-09
          ],
          [
            4.463253695879981e-10,
            -0.0738925669647157,
            2.941170670230826e-09
          ],
          [
            5.330579904340513e-10,
            -0.02387658978563255,
            3.493939608770387e-09
          ],
          [
            6.386008639265402e-10,
            0.03143012657397578,
            4.0286995899400794e-09
          ],
          [
            7.595198009048606e-10,
            0.08705566804519424,
            4.544783842491173e-09
          ]
        ],
        "berry_integer_shifts": [
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ],
          [
            0,
            0,
            0
          ]
        ],
        "folded_reduced_polarization": [
          [
            -7.595206130694976e-10,
            -0.08705566804519649,
            -4.5447846597213015e-09
          ],
          [
            -6.386018380766245e-10,
            -0.03143012657397576,
            -4.028700095748405e-09
          ],
          [
            -5.330583752183315e-10,
            0.02387658978563245,
            -3.4939399706779284e-09
          ],
          [
            -4.463254210662626e-10,
            0.0738925669647158,
            -2.941170529346948e-09
          ],
          [
            -3.692886552109087e-10,
            0.11054984508609333,
            -2.37395553215336e-09
          ],
          [
            -2.9007291013627423e-10,
            0.12309589860517911,
            -1.7967515253403121e-09
          ],
          [
            -2.011429911519258e-10,
            0.10436299477353783,
            -1.2112530978214409e-09
          ],
          [
            -1.0248624171538268e-10,
            0.05883236534533176,
            -6.126845142340187e-10
          ],
          [
            -7.771561172376096e-16,
            -1.1102230246251565e-16,
            -1.1657341758564144e-15
          ],
          [
            1.0248324411321619e-10,
            -0.058832365345332205,
            6.126822382768182e-10
          ],
          [
            2.0114254706271595e-10,
            -0.10436299477353617,
            1.2112527647545335e-09
          ],
          [
            2.9007329871433285e-10,
            -0.12309589860517889,
            1.7967515253403121e-09
          ],
          [
            3.692882666328501e-10,
            -0.11054984508609378,
            2.3739553656199064e-09
          ],
          [
            4.463254210662626e-10,
            -0.07389256696471569,
            2.9411706403692506e-09
          ],
          [
            5.330580421514242e-10,
            -0.023876589785632563,
            3.4939395820998698e-09
          ],
          [
            6.386008388759024e-10,
            0.031430126573975814,
            4.028699596148044e-09
          ],
          [
            7.595197804022291e-10,
            0.08705566804519427,
            4.544783882565184e-09
          ]
        ]
      },
      "incoming_structure_ids": [
        "incoming_00_000",
        "incoming_00_001",
        "incoming_00_002",
        "incoming_00_003",
        "incoming_00_004",
        "incoming_00_005",
        "incoming_00_006",
        "incoming_00_007",
        "incoming_00_008"
      ],
      "reflected_structure_ids": [
        "reflected_00_001",
        "reflected_00_002",
        "reflected_00_003",
        "reflected_00_004",
        "reflected_00_005",
        "reflected_00_006",
        "reflected_00_007",
        "reflected_00_008"
      ],
      "positive_extension_structure_ids": [
        "extension_plus_00_000",
        "extension_plus_00_001",
        "extension_plus_00_002",
        "extension_plus_00_003"
      ],
      "negative_extension_structure_ids": [
        "extension_minus_00_000",
        "extension_minus_00_001",
        "extension_minus_00_002",
        "extension_minus_00_003"
      ],
      "extension": {
        "enabled": true,
        "fraction_beyond_polar_endpoint": 0.35,
        "images_per_side": 4,
        "construction": "continue fractional atomic displacements and symmetric log strain beyond +P; reflect these structures about N for the -P side",
        "positive_path_coordinates": [
          1.35,
          1.2625,
          1.175,
          1.0875
        ],
        "negative_path_coordinates": [
          -1.0875,
          -1.175,
          -1.2625,
          -1.35
        ]
      },
      "branch_coordinates": [
        1.35,
        1.2625,
        1.175,
        1.0875,
        1.0,
        0.875,
        0.75,
        0.625,
        0.5,
        0.375,
        0.25,
        0.125,
        0.0,
        -0.125,
        -0.25,
        -0.375,
        -0.5,
        -0.625,
        -0.75,
        -0.875,
        -1.0,
        -1.0875,
        -1.175,
        -1.2625,
        -1.35
      ],
      "parent": {
        "candidate_id": "inversion_parent_endpoint_00",
        "source": "same_species_inversion_center_projection_from_endpoint",
        "spacegroup": "P2_1/m",
        "spacegroup_number": 11,
        "pointgroup": "2/m",
        "has_inversion": true,
        "is_polar_point_group": false,
        "nonpolar_parent_hypothesis": true,
        "symmetry_tolerance_A": null,
        "target_reduced_polarization": [
          0.0,
          0.0,
          0.0
        ],
        "formal_class": [
          0.0,
          0.0,
          0.0
        ],
        "target_residual": 1.634630844626559e-16,
        "parent_symmetrization_rmsd_A": 0.30584634084927315,
        "parent_cell_rmsd_A": 0.0,
        "energy_eV": -52.425550969721925,
        "reduced_polarization": [
          -6.872665728327962e-17,
          1.4795598519657023e-16,
          1.0288488967010106e-17
        ],
        "cartesian_polarization_e_A2": [
          -1.859045826264422e-18,
          2.702183245972016e-18,
          3.0984097104407036e-19
        ],
        "ranking_score": 0.3058463408492735
      }
    }
  ],
  "path_sampling": {
    "num_images": 17,
    "images_per_leg_including_parent": 9,
    "extension_fraction_beyond_polar_endpoint": 0.35,
    "extension_images_per_side": 4,
    "total_images_per_sampled_branch": 25,
    "construction": "linear polar-to-parent interpolation plus parent-reflected second leg and symmetric log-strain continuation beyond both polar endpoints"
  },
  "branch_folding": "componentwise integer unwrap with per-image shifts, then reduced-coordinate fold [-0.5, 0.5)",
  "bec_backprojection_settings": {
    "variable_cell": true,
    "max_strain_step_log_component": 0.02,
    "strain_response_refresh_iterations": 4,
    "cell_principal_stretch_bounds": [
      0.85,
      1.15
    ],
    "cell_volume_ratio_bounds": [
      0.7,
      1.3
    ],
    "strain_jacobian": "branch-matched finite differences of reduced polarization in six symmetric log-strain coordinates at fixed fractional positions"
  },
  "model_input_contract": "one polar endpoint structure; no reference parent or path frame",
  "run": {
    "model_file": "MACEField-MH-0-omat-dielectric.model",
    "model_sha256": "f92e043aaf2cd8879919db8452503553fe7b608cb749d8d169dd96d4aa094aa2",
    "model_head": "mp-ferroelectric",
    "device": "cpu",
    "dtype": "float64",
    "num_images": 17,
    "compute_becs_for_every_image": true,
    "compute_polarizability_for_every_image": true,
    "initial_structure_relaxation": {
      "enabled": false
    },
    "model_evaluations_for_recovery": {
      "total": 129,
      "full_response": 34,
      "energy_polarization": 95
    },
    "model_evaluations_for_recovery_and_path_properties": {
      "total": 154,
      "full_response": 59,
      "energy_polarization": 95
    },
    "elapsed_seconds": 237.57756422297098
  }
}
