{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [-3.930389, -2.301766, 0.0, -3.930389, 2.301766, 0.0, 0.0, 0.0, -9.707193]]}, "__ase_objtype__": "cell"}, "ctime": 24.89146279620028, "dipole": {"__ndarray__": [[3], "float64", [-2.9602221170711413e-05, -2.438966154267655e-07, -7.74618910278453e-05]]}, "energy": -5.913702327707137, "forces": {"__ndarray__": [[4, 3], "float64", [1.191374225640451e-12, -0.03044797050451292, -0.06416062490363822, 2.6212009719709905e-12, -0.030489644792590982, 0.06421095548110113, 2.6975140214258505e-12, 0.030487020124275444, -0.06401621278480958, 1.0128718617776526e-12, 0.030445289514097376, 0.06396592481623135]]}, "mtime": 24.89146279620028, "numbers": {"__ndarray__": [[4], "int64", [53, 53, 53, 53]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[4, 3], "float64", [-3.9303899998909615, 1.5427999998363005, -1.18471999985694, -3.930389999890962, -0.758959999920091, -3.6688700002066272, -3.9303899998909615, 0.7589599999200909, -6.038309999920507, -3.9303899998909615, -1.5427999998363005, -8.522479999999932]]}, "stress": {"__ndarray__": [[6], "float64", [-0.0039709308087071005, -0.0032751594116677885, -0.0043345236854542835, -3.8437778216666196e-08, -3.887965831543708e-16, -1.063697190367672e-15]]}, "unique_id": "dfc3f6115333cb1b30b3a119e78c2e29", "user": "cmr"}, "ids": [1], "nextid": 2}