{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [6.07258360033, 0.0, 0.0, 0.19608640105857053, 6.069416912319499, 0.0, 0.1429920101375553, 0.13844693451624931, 12.150359057000477]]}, "__ase_objtype__": "cell"}, "ctime": 24.383293904562294, "energy": -112.41552592517968, "initial_magmoms": {"__ndarray__": [[22], "float64", [4.534480067150559e-08, -3.634754060360045e-08, 4.550042306809184e-08, -3.676928108670644e-08, 4.888898175730103e-08, -3.982123540892611e-08, 5.035582226008809e-08, -4.141802832040303e-08, 4.847435456313552e-08, -3.940447748037308e-08, 4.3994872147839036e-08, -3.506256909986057e-08, 4.113640719960932e-08, -3.131402839232907e-08, 5.836372225937996e-08, -5.166047774962015e-08, 6.279272557079423e-08, -5.3052073635511725e-08, 7.091162160244456e-08, -5.524243685615056e-08, 6.511644708289618e-08, -5.2101281059531975e-08]]}, "magmom": 1.086867484900722e-07, "mtime": 24.383293904562294, "numbers": {"__ndarray__": [[22], "int64", [33, 33, 33, 33, 33, 33, 33, 33, 33, 33, 33, 33, 38, 38, 78, 78, 78, 78, 78, 78, 78, 78]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[22, 3], "float64", [0.8918770993048957, 0.6270405091102534, 3.747547394309714, 5.684653377501548, 5.267475783420056, 2.3276321341905244, 5.51978491222123, 5.580823337725495, 8.402811662690763, 0.7270086340245777, 0.940388063415693, 9.822726922809952, 5.596321218283892, 3.9140822987563193, 11.46613588742361, 2.390409124710997, 0.8100718653176626, 6.759402698077106, 0.8153407932422327, 2.2937815480794295, 0.6842231695768679, 4.0212528868151285, 5.397791981518085, 5.390956358923371, 2.514684577924111, 5.328939558971769, 0.6677472826955753, 0.9328050646778724, 3.7973409486105676, 5.407432245804664, 5.478856946848253, 2.410522898225181, 6.742926811195814, 3.8969774336020153, 0.8789242878639797, 11.482611774304901, 2.67698866338025, 3.721668956314945, 9.112769292750357, 3.734673348145876, 2.486194890520804, 3.0375897642501193, 5.813840309565447, 3.1755142579795135, 9.1091970871876, 3.1215682352910252, 0.5688175174372577, 9.116341498313115, 3.205831005763063, 3.1039319234178744, 6.075179528500239, 3.134335000694285, 3.0347084561597497, 0.0, 0.07149600506877765, 0.06922346725812466, 6.075179528500239, 0.0, 0.0, 0.0, 3.2900937762351004, 5.639046329398491, 3.0340175586873612, 0.5978217019606787, 3.0323495888562357, 3.041161969812878]]}, "unique_id": "31176ce3992ec9303387d3cf65c18018", "user": "cmr"}, "ids": [1], "nextid": 2}