{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [2.878716, -2.878716, 0.0, -2.878716, 0.0, -2.878716, 2.878716, 2.878716, 0.0]]}, "__ase_objtype__": "cell"}, "ctime": 24.72288095285462, "dipole": {"__ndarray__": [[3], "float64", [0.003021699274282197, -3.1613962673509866, 0.00301286545948188]]}, "energy": -9.031702577499647, "forces": {"__ndarray__": [[2, 3], "float64", [0.0011562053151112268, -0.0011562053151112268, -0.0011562053151112268, -0.001156205369739888, 0.001156205369739888, 0.001156205369739888]]}, "mtime": 24.72288095285462, "numbers": {"__ndarray__": [[2], "int64", [32, 32]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[2, 3], "float64", [0.0, 0.0, 0.0, 1.4393599998440048, -1.439359999844005, -1.4393600001318767]]}, "stress": {"__ndarray__": [[6], "float64", [-0.001583234477009918, -0.001583234477009918, -0.0015832344770099179, -9.743556752521884e-07, 9.743556752521763e-07, 9.743556752521884e-07]]}, "unique_id": "e9cc4376a88835b10608c3ac47a41028", "user": "cmr"}, "ids": [1], "nextid": 2}