{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 4.270256 1.710461 1.859562 ] [ 3.221228 2.921425 3.621771 ] [ 5.235708 4.080044 2.534096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.270256e-10 1.710461e-10 1.859562e-10 ] [ 3.221228e-10 2.921425e-10 3.621771e-10 ] [ 5.235708e-10 4.080044e-10 2.534096e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4976992 2.71536 1.3323032 ] [ 2.4994917 0.7216495 -1.8214101 ] [ -2.9971909 -3.4370095 0.489107 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.974020224308633e-10 4.350486309055488e-09 2.134585038857026e-09 ] [ 4.004627165623648e-09 1.15620995731201e-09 -2.91822067910899e-09 ] [ -4.80202918805451e-09 -5.506696266367497e-09 7.836358004696257e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8908111 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.43811982196913e-19 } "relaxed-configuration-positions" { "source-value" [ [ 4.336192 1.7702899 1.8383996 ] [ 3.2300259 2.9776363 3.6507345 ] [ 5.1609741 3.9640039 2.5262949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.336192e-10 1.7702899e-10 1.8383996e-10 ] [ 3.2300259e-10 2.9776363e-10 3.6507345e-10 ] [ 5.160974099999999e-10 3.9640039e-10 2.5262949e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -1e-07 -1e-07 ] [ -1e-07 -0.0 0.0 ] [ 1e-07 1e-07 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -1.6021766208e-16 -1.6021766208e-16 ] [ -1.6021766208e-16 0.0 0.0 ] [ 1.6021766208e-16 1.6021766208e-16 0.0 ] ] } "relaxed-potential-energy" { "source-value" -6.288679 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.007557446951592e-18 } }