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{
    "@class": "Potential",
    "@module": "matgl.apps.pes",
    "@model_version": 3,
    "metadata": {
        "dataset": "pbe",
        "backend": "PYG"
    },
    "kwargs": {
        "model": {
            "@class": "M3GNet",
            "@module": "matgl.models",
            "@model_version": 2,
            "init_args": {
                "element_types": [
                    "H",
                    "He",
                    "Li",
                    "Be",
                    "B",
                    "C",
                    "N",
                    "O",
                    "F",
                    "Ne",
                    "Na",
                    "Mg",
                    "Al",
                    "Si",
                    "P",
                    "S",
                    "Cl",
                    "Ar",
                    "K",
                    "Ca",
                    "Sc",
                    "Ti",
                    "V",
                    "Cr",
                    "Mn",
                    "Fe",
                    "Co",
                    "Ni",
                    "Cu",
                    "Zn",
                    "Ga",
                    "Ge",
                    "As",
                    "Se",
                    "Br",
                    "Kr",
                    "Rb",
                    "Sr",
                    "Y",
                    "Zr",
                    "Nb",
                    "Mo",
                    "Tc",
                    "Ru",
                    "Rh",
                    "Pd",
                    "Ag",
                    "Cd",
                    "In",
                    "Sn",
                    "Sb",
                    "Te",
                    "I",
                    "Xe",
                    "Cs",
                    "Ba",
                    "La",
                    "Ce",
                    "Pr",
                    "Nd",
                    "Pm",
                    "Sm",
                    "Eu",
                    "Gd",
                    "Tb",
                    "Dy",
                    "Ho",
                    "Er",
                    "Tm",
                    "Yb",
                    "Lu",
                    "Hf",
                    "Ta",
                    "W",
                    "Re",
                    "Os",
                    "Ir",
                    "Pt",
                    "Au",
                    "Hg",
                    "Tl",
                    "Pb",
                    "Bi",
                    "Ac",
                    "Th",
                    "Pa",
                    "U",
                    "Np",
                    "Pu"
                ],
                "dim_node_embedding": 64,
                "dim_edge_embedding": 64,
                "dim_state_embedding": 0,
                "ntypes_state": null,
                "dim_state_feats": null,
                "max_n": 3,
                "max_l": 3,
                "nblocks": 3,
                "rbf_type": "SphericalBessel",
                "is_intensive": false,
                "readout_type": "weighted_atom",
                "task_type": "regression",
                "cutoff": 5.0,
                "threebody_cutoff": 4.0,
                "units": 64,
                "ntargets": 1,
                "use_smooth": false,
                "use_phi": false,
                "niters_set2set": 3,
                "nlayers_set2set": 3,
                "field": "node_feat",
                "include_state": false,
                "activation_type": "swish",
                "dropout": null
            }
        },
        "data_mean": 0.0,
        "data_std": 1.9108102321624756,
        "element_refs": "[-1.1172323e+00 -4.5595001e-04 -2.9734918e-01 -4.2623531e-02\n -2.9117119e-01 -1.2628180e+00 -3.1255562e+00 -1.5469077e+00\n -4.3794546e-01 -1.2160230e-02 -2.2858275e-01 -9.9462699e-03\n -2.1672837e-01 -8.2583189e-01 -1.8871967e+00 -8.9091718e-01\n -2.5828680e-01 -2.3531500e-02 -1.7827125e-01 -2.5962170e-02\n -2.1296690e+00 -2.4053226e+00 -3.6123278e+00 -5.4462061e+00\n -5.1459265e+00 -3.3058336e+00 -1.6661459e+00 -2.8412402e-01\n -2.3745593e-01 -1.0983510e-02 -1.9854295e-01 -7.7924663e-01\n -1.7013648e+00 -7.8345919e-01 -2.2687513e-01 -2.2653960e-02\n -1.6194043e-01 -2.8231449e-02 -2.2567961e+00 -2.2374291e+00\n -2.5348191e+00 -4.6021328e+00 -3.4028971e+00 -1.6888429e+00\n -1.4401606e+00 -1.4752114e+00 -1.9840574e-01 -1.3747870e-02\n -1.9672488e-01 -6.7963499e-01 -1.4302063e+00 -6.5731227e-01\n -1.8858477e-01 -1.0202840e-02 -1.3452777e-01 -1.3597841e+00\n -6.2794477e-01 -1.4364282e+00 -2.1270690e+00 -3.6389802e+00\n -5.0885992e+00 -6.9970226e+00 -9.4860630e+00 -8.1154003e+00\n -6.4568624e+00 -5.5164018e+00 -4.3011146e+00 -3.0388057e+00\n -2.1051388e+00 -1.8404071e+00 -2.5255978e-01 -3.4929240e+00\n -3.5659313e+00 -4.5710111e+00 -4.6343679e+00 -2.8828082e+00\n -1.4279357e+00 -5.0244445e-01 -1.8479218e-01 -1.0521200e-02\n -1.7939998e-01 -6.3069886e-01 -1.3246238e+00 -2.4210133e-01\n -1.0441915e+00 -2.0323901e+00 -4.6443114e+00 -7.3027349e+00\n -1.0392446e+01]",
        "calc_forces": true,
        "calc_stresses": true,
        "calc_hessian": false,
        "calc_magmom": false,
        "calc_charge": false,
        "calc_repuls": false,
        "zbl_trainable": false,
        "debug_mode": false
    }
}