{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [8.213973, 1.939971, -0.000386, 0.776065, 3.987792, -0.000708, -0.000583, -0.001852, 15.019962]]}, "__ase_objtype__": "cell"}, "ctime": 24.378739460620718, "energy": -2192.14477626, "mtime": 24.378739460620718, "numbers": {"__ndarray__": [[20], "int64", [83, 83, 83, 83, 47, 47, 47, 47, 16, 16, 16, 16, 16, 16, 16, 16, 16, 16, 16, 16]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[20, 3], "float64", [6.25768, 2.502035, 6.422124, 2.150616, 1.533612, 1.087435, 2.731774, 3.423875, 8.596743, 6.838838, 4.392298, 13.931432, 3.487435, 1.544653, 11.578452, -0.620687, 0.570996, 10.950255, 5.502019, 4.381258, 3.440416, 9.610141, 5.354914, 4.068612, 8.639577, 3.690639, 8.560089, 4.532789, 2.719622, 13.968304, 0.349878, 2.235271, 6.458778, 4.456665, 3.206288, 1.050563, 8.051846, 1.955499, 1.058531, 3.945175, 0.984117, 6.450024, 0.937608, 3.970411, 13.960336, 5.044279, 4.941793, 8.568844, 6.497138, 2.15222, 3.910392, 2.390967, 1.184929, 3.599607, 2.492316, 3.77369, 11.108475, 6.598487, 4.740981, 11.41926]]}, "unique_id": "9edf04fcb4bda0f68a43dfedc210f2ab", "user": "cmr"}, "ids": [1], "nextid": 2}