{"1": { "calculator": "unknown", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [3.8082882665408047, -2.951995002254957e-20, 0.0, -9.132662063000487e-16, 6.568524897931374, 0.0, 1.6473860412608888e-18, 0.0, 18.823797729127772]]}, "__ase_objtype__": "cell"}, "ctime": 24.994176408857477, "dipole": {"__ndarray__": [[3], "float64", [2.1121525199012813e-15, -9.541260128442, 2.320699195190784e-08]]}, "energy": -28.78284886533441, "free_energy": -28.793435428256632, "mtime": 24.994176408857477, "numbers": {"__ndarray__": [[6], "int64", [41, 53, 53, 41, 53, 53]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, false]]}, "positions": {"__ndarray__": [[6, 3], "float64", [-0.0, 0.55450504, 9.53529967, 1.90414413, 1.13468944, 11.53329115, 0.0, 2.14957313, 7.29050656, 1.90414413, 2.72975749, 9.28849805, 3.80828827, 4.42841991, 10.97778419, 1.90414413, 5.42436744, 7.84601352]]}, "unique_id": "ca221a22be72bca331a8005e76c1849c", "user": "cmr"}, "ids": [1], "nextid": 2}