{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [5.745312050123986, 0.0, 0.0, 4.0625783638826347e-16, 6.097247535511205, 0.0, 4.0625783638826347e-16, -3.0486237677556036, 5.280371258914763]]}, "__ase_objtype__": "cell"}, "ctime": 24.924752432871898, "dipole": {"__ndarray__": [[3], "float64", [4.87427468024228e-14, -1.2047160791459022e-13, 8.806041418497474e-14]]}, "energy": 381.7601657126457, "forces": {"__ndarray__": [[10, 3], "float64", [-7.433588913759263e-18, -1.8583972284398158e-18, 0.0, -1.858397228439816e-17, 2.787595842659724e-18, 0.0, -3.380404866111013e-30, -4.225506082638767e-31, 0.0, 8.451012165277534e-30, -4.225506082638767e-31, 0.0, 2.9037456694372123e-19, -0.03560385140439149, 0.020555893192512876, -9.291986142199079e-19, 9.29198614219908e-18, -0.04111178638502574, 1.8583972284398158e-18, 0.035603851404391505, 0.020555893192512876, -1.684172488273583e-18, 0.035603851404391526, -0.02055589319251287, 1.8583972284398158e-18, -3.7167944568796316e-18, 0.04111178638502574, -1.8583972284398158e-18, -0.035603851404391505, -0.020555893192512876]]}, "mtime": 24.924752432871898, "numbers": {"__ndarray__": [[10], "int64", [44, 44, 15, 15, 34, 34, 34, 34, 34, 34]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[10, 3], "float64", [4.308984037592989, -9.669056294243147e-16, 3.5202475059431757, 1.436328012530997, 3.0486237677556014, 1.7601237529715879, 2.872656025061993, 2.3219897816718378e-30, 4.016182683470436e-30, -6.142742687582505e-29, -4.355346786368116e-31, -3.8927054821355124e-31, 1.4363280125309967, -1.4052055867609425, 4.331543329726373, 1.4363280125309967, -6.071147798106505e-16, 1.8976558583767893, 1.436328012530997, 1.4052055867609399, 4.331543329726373, 4.308984037592989, 4.453829354516534, 0.9488279291883946, 4.30898403759299, 3.048623767755602, 3.382715400537972, 4.308984037592989, 1.6434181809946604, 0.9488279291883946]]}, "stress": {"__ndarray__": [[6], "float64", [-0.00010648019449832487, -0.00033838124478170295, -0.0003383812447817007, -1.0369464037339422e-18, 0.0, 0.0]]}, "unique_id": "b80073b7c53170d413c98bb94bc0a8e3", "user": "cmr"}, "ids": [1], "nextid": 2}