{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [7.666942186633921, -1.8369430309702922e-17, -1.4637522847348785e-17, 3.8865459947392027e-16, 6.432144060421793, -9.572103034482033e-06, 3.738027116589802e-16, -7.889801715246316e-06, 5.867270060234689]]}, "__ase_objtype__": "cell"}, "ctime": 24.37624303415637, "energy": 313.85409439041985, "forces": {"__ndarray__": [[16, 3], "float64", [0.0, 0.0058810666926490006, -0.004029038223469473, 0.0, 0.0018326057810236732, -0.004150653249963059, 0.0, -0.00011274546685293391, -0.002278724450430995, -1.7422474016623274e-19, 4.788984471885926e-05, -0.0031884586619864447, -0.00044284716867887296, 0.00014506379280183578, 0.0008005467244827557, 0.00044284716867887296, 0.00014506379280183578, 0.0008005467244827557, -2.658085812732852e-05, -0.00038934097165781357, 0.000262876325153239, 2.658085812732852e-05, -0.00038934097165781357, 0.000262876325153239, 0.0, -0.0010763155832410661, 0.0037359968575489955, 0.0, 0.0012891067302158393, 0.003919450558925269, -3.484494803324655e-19, -0.004511921512813907, -0.0018032011963478077, 0.0, -0.0010195079292923991, -0.0004960845197762876, -0.002927874761358371, -0.001094553958957092, 0.0012090859987854365, 0.002927874761358371, -0.001094553958957092, 0.0012090859987854365, 0.00044221165725495437, 0.00017427493262355456, 0.0019674408793522082, -0.00044221165725495437, 0.00017427493262355456, 0.0019674408793522082]]}, "mtime": 24.37624303415637, "numbers": {"__ndarray__": [[16], "int64", [40, 40, 4, 4, 29, 29, 29, 29, 16, 16, 16, 16, 16, 16, 16, 16]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[16, 3], "float64", [3.8334710933169616, 1.0410131729199346, 3.6263647927726583, -2.375880190431939e-17, 5.390763759295297, 0.6927279824522089, 3.8334710933169625, 5.274601945944024, 5.552554195127684, -1.6014642199417813e-16, 1.15744649346186, 2.6189358821864683, 5.798505168335169, 4.380314696363696, 2.5644711380296217, 1.8684370182988164, 4.380314696363696, 2.5644711380296217, 5.701943049542386, 2.0517391637705042, 5.498116963883134, 1.96499913709152, 2.0517391637705042, 5.498116963883134, 3.8334710933169616, 0.896197385986249, 0.26005503589993134, 1.5386974904260172e-16, 5.535824966899965, 3.193675875320835, 3.8334710933169625, 5.08494337508538, 3.4451702357816703, -2.84587235527705e-16, 1.3472600165475297, 0.5114972272394732, 5.547137079846375, 4.251711992673124, 0.32364053960517725, 2.1198051067875316, 4.251711992673124, 0.3236405396051773, 5.953363718420539, 2.1803463333550175, 3.257256779018332, 1.7135784682133637, 2.1803463333550175, 3.257256779018332]]}, "stress": {"__ndarray__": [[6], "float64", [-9.426471693027539e-06, 1.4472513385939429e-05, -9.467147011911396e-05, -4.51496383227744e-06, 0.0, 0.0]]}, "unique_id": "948bd9b0f0b70fd69ac38825b59cef44", "user": "cmr"}, "ids": [1], "nextid": 2}