{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [8.89634769673294, 0.0, 0.0, 6.29071308137987e-16, 5.763947489435914, 0.0, 6.29071308137987e-16, -2.8819737447179583, 4.991724951931043]]}, "__ase_objtype__": "cell"}, "ctime": 24.973850114099285, "dipole": {"__ndarray__": [[3], "float64", [2.7037594923550728e-14, -3.253227945405968e-14, -2.231671603876655e-14]]}, "energy": 363.61653523236174, "forces": {"__ndarray__": [[10, 3], "float64", [2.540777460757561e-20, 4.6459930710995395e-19, 0.0, -2.540777460757561e-20, 0.0, 0.0, -2.1127530413193833e-31, 0.0, 8.451012165277533e-31, 1.6902024330555067e-30, 0.0, 8.451012165277533e-31, -6.96898960664931e-19, 0.013885372310578027, -0.008016723441310407, 2.787595842659724e-18, -3.7167944568796316e-18, 0.016033446882620813, -2.787595842659724e-18, -0.013885372310578027, -0.00801672344131041, -5.807491338874425e-19, -0.013885372310578023, 0.008016723441310407, -4.64599307109954e-18, 1.8583972284398158e-18, -0.01603344688262081, 3.7167944568796316e-18, 0.01388537231057803, 0.008016723441310407]]}, "mtime": 24.973850114099285, "numbers": {"__ndarray__": [[10], "int64", [15, 15, 39, 39, 34, 34, 34, 34, 34, 34]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[10, 3], "float64", [6.672260772549705, -9.080417328147904e-16, 3.3278166346206954, 2.224086924183236, 2.881973744717956, 1.6639083173103477, 4.44817384836647, -3.570409443851046e-26, -4.4730428347342535e-27, 1.1338781790307612e-28, -5.3097697708514035e-30, 5.355116340261086e-26, 2.2240869241832355, -1.3786366701612438, 4.123772887252977, 2.2240869241832355, -4.4400826654223427e-16, 1.7359041293561266, 2.224086924183236, 1.3786366701612398, 4.123772887252977, 6.672260772549705, 4.260610414879201, 0.8679520646780634, 6.672260772549706, 2.8819737447179565, 3.2558208225749126, 6.672260772549704, 1.5033370745567138, 0.8679520646780643]]}, "stress": {"__ndarray__": [[6], "float64", [0.0008709056268800369, 0.0006919585354171085, 0.0006919585354171041, 4.1477856149357687e-19, -1.5554196056009133e-19, -8.263166654754852e-20]]}, "unique_id": "1cedcb8cca8998bc653ff621aa6725ff", "user": "cmr"}, "ids": [1], "nextid": 2}