{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.3922267e-10 -1.890058e-11 7.345562e-11 ] [ -1.736742e-11 1.197779e-11 2.5309355e-10 ] [ 3.738921e-11 2.4002003e-10 2.61299e-10 ] [ 2.1125441e-10 -4.42176e-11 3.0140023e-10 ] [ 1.943863e-10 2.0903471e-10 8.192893e-11 ] [ 2.6598367e-10 1.8382525e-10 3.0989357e-10 ] ] "source-value" [ [ 1.3922267 -0.1890058 0.7345562 ] [ -0.1736742 0.1197779 2.5309355 ] [ 0.3738921 2.4002003 2.61299 ] [ 2.1125441 -0.442176 3.0140023 ] [ 1.943863 2.0903471 0.8192893 ] [ 2.6598367 1.8382525 3.0989357 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.29319247309568e-12 9.9126667528896e-13 6.17911457343936e-12 ] [ 4.15652680734144e-12 3.37931092859136e-12 2.9047462135104e-13 ] [ 4.55947422747264e-12 9.582618369004799e-13 -1.63149645296064e-12 ] [ -8.5412035654848e-13 -2.16357930872832e-12 -3.06127886936256e-12 ] [ -5.484731225984641e-12 1.22999099178816e-12 -1.53536585571264e-12 ] [ -6.67034192537664e-12 -4.39525112384064e-12 -2.4144801675456e-13 ] ] "source-value" [ [ 0.0026796 0.0006187 0.0038567 ] [ 0.0025943 0.0021092 0.0001813 ] [ 0.0028458 0.0005981 -0.0010183 ] [ -0.0005331 -0.0013504 -0.0019107 ] [ -0.0034233 0.0007677 -0.0009583 ] [ -0.0041633 -0.0027433 -0.0001507 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.270266787779712e-18 "source-value" -20.4114 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.034350486363569e-09 -1.387109691804676e-08 -2.666501973213857e-08 ] [ -1.933005408895026e-08 -1.609141827310669e-08 1.459995702355149e-08 ] [ -9.538279893418442e-09 2.571296440703174e-08 3.05937628462536e-09 ] [ 9.569115224444697e-09 -2.22985643684859e-08 7.937727238841287e-09 ] [ 6.786801420242337e-09 1.0098114050435e-08 -1.411489340529209e-08 ] [ 1.147806685131809e-08 1.645000094195495e-08 1.518285259041252e-08 ] ] "source-value" [ [ 0.6455908 -8.6576578 -16.6429964 ] [ -12.0648709 -10.0434734 9.1125765 ] [ -5.9533261 16.0487702 1.9095125 ] [ 5.972572 -13.9176693 4.9543397 ] [ 4.2359883 6.3027471 -8.8098236 ] [ 7.1640459 10.2672831 9.4763913 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.920018841135849e-19 "source-value" -5.5674379 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.009597e-10 3.628337e-11 1.078601e-10 ] [ 3.523669e-12 1.167127e-11 2.680629e-10 ] [ 3.335965e-11 1.756245e-10 2.167544e-10 ] [ 2.066416e-10 7.297679e-13 2.832654e-10 ] [ 2.311694e-10 1.962933e-10 1.086024e-10 ] [ 2.552148e-10 1.611374e-10 2.965257e-10 ] ] "source-value" [ [ 1.009597 0.3628337 1.078601 ] [ 0.03523669 0.1167127 2.680629 ] [ 0.3335965 1.756245 2.167544 ] [ 2.066416 0.007297679 2.832654 ] [ 2.311694 1.962933 1.086024 ] [ 2.552148 1.611374 2.965257 ] ] } "instance-id" 1 }