{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.009597 0.3628337 1.078601 ] [ 0.0352367 0.1167127 2.680629 ] [ 0.3335965 1.756245 2.167544 ] [ 2.066416 0.0072977 2.832654 ] [ 2.311694 1.962933 1.086024 ] [ 2.552148 1.611374 2.965257 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.009597e-10 3.628337e-11 1.078601e-10 ] [ 3.52367e-12 1.167127e-11 2.680629e-10 ] [ 3.335965e-11 1.756245e-10 2.167544e-10 ] [ 2.066416e-10 7.2977e-13 2.832654e-10 ] [ 2.311694e-10 1.962933e-10 1.086024e-10 ] [ 2.552148e-10 1.611374e-10 2.965257e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.5178589 -15.4544929 -30.6333263 ] [ -21.0403592 -24.7927773 20.3366535 ] [ -33.5029492 35.3692188 1.0292615 ] [ 4.241538 -26.1668999 6.4385892 ] [ 14.3722283 10.5132826 -16.9508065 ] [ 30.4116832 20.5316687 19.7796286 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.840584526453206e-09 -2.476082721069959e-08 -4.907999921519777e-08 ] [ -3.371037160347419e-08 -3.972240815476095e-08 3.25829107830105e-08 ] [ -5.367764193609007e-08 5.666773545731983e-08 1.649058711989539e-09 ] [ 6.795693019834791e-09 -4.192399525859386e-08 1.031575708717538e-08 ] [ 2.302684817106013e-08 1.684413558958344e-08 -2.715818587800467e-08 ] [ 4.872488782221613e-08 3.289535957715113e-08 3.169045851102704e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.426507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.952251871840755e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0105851 0.9539852 -0.2594146 ] [ 0.0844185 0.1124372 3.1606396 ] [ -0.9983572 1.6689963 2.0478456 ] [ 2.1320321 -0.0813362 3.9566632 ] [ 2.5840595 1.8544959 0.9838908 ] [ 3.4959503 1.3088176 2.9210843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0105851e-10 9.539852e-11 -2.594146e-11 ] [ 8.44185e-12 1.124372e-11 3.1606396e-10 ] [ -9.983572e-11 1.6689963e-10 2.0478456e-10 ] [ 2.1320321e-10 -8.13362e-12 3.9566632e-10 ] [ 2.5840595e-10 1.8544959e-10 9.838908e-11 ] [ 3.4959503e-10 1.3088176e-10 2.9210843e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1142833 0.0877268 -0.2648202 ] [ 0.1817802 -0.1647382 0.3464993 ] [ -0.2705616 0.0053727 -0.0955565 ] [ -0.2093154 0.0452505 0.0555717 ] [ 0.5857493 -0.0856702 0.5899055 ] [ -0.1733692 0.1120584 -0.6315998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.831020314078726e-10 1.405538279775974e-10 -4.242887331555802e-10 ] [ 2.912439865643482e-10 -2.639396925926746e-10 5.551530775835655e-10 ] [ -4.334874700062413e-10 8.60801433057216e-12 -1.530983902654752e-10 ] [ -3.353602402534003e-10 7.24992931795104e-11 8.903567851811136e-11 ] [ 9.384738341099654e-10 -1.372587915392602e-10 9.451328005813344e-10 ] [ -2.777680790067994e-10 1.795373486442547e-10 -1.011934433261956e-09 ] ] } "relaxed-potential-energy" { "source-value" -12.797578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.050398027446442e-18 } }