{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4898779 -2.1447591 -0.0449188 ] [ -0.1102187 -4.299901 1.7658198 ] [ -1.8613399 -0.2356566 -0.7850175 ] [ 1.0163159 1.8773193 -1.5379014 ] [ 1.7261801 1.4233199 0.9391055 ] [ -1.9132179 1.8069742 -4.2851547 ] [ 1.6321584 1.5727034 3.948067 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.848709184266003e-10 -3.436282887268049e-09 -7.196785119439104e-11 ] [ -1.76589824314969e-10 -6.889200853954542e-09 2.829155200105732e-09 ] [ -2.98219527114221e-09 -3.775634950572173e-10 -1.257736685418864e-09 ] [ 1.628317574327311e-09 3.007797092236621e-09 -2.463989668175589e-09 ] [ 2.765645399510206e-09 2.280409867699394e-09 1.504612876564695e-09 ] [ -3.065312989876073e-09 2.895091817628783e-09 -6.865574676851237e-09 ] [ 2.615006029922335e-09 2.519748618932671e-09 6.325500644751993e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.241159085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.16016157943977e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1670591 2.3499703 2.2191441 ] [ 4.4176004 1.5196195 1.8602994 ] [ 5.4423713 2.1976362 3.9515485 ] [ 3.2811779 1.4363205 4.0015079 ] [ 5.6639443 3.5817775 2.1382851 ] [ 3.6396777 3.6759449 1.0676263 ] [ 3.6601052 3.7770334 3.4909567 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1670591e-10 2.3499703e-10 2.2191441e-10 ] [ 4.417600400000001e-10 1.5196195e-10 1.8602994e-10 ] [ 5.4423713e-10 2.1976362e-10 3.9515485e-10 ] [ 3.2811779e-10 1.4363205e-10 4.0015079e-10 ] [ 5.6639443e-10 3.5817775e-10 2.1382851e-10 ] [ 3.6396777e-10 3.6759449e-10 1.0676263e-10 ] [ 3.6601052e-10 3.7770334e-10 3.4909567e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3e-06 -2.49e-05 3.67e-05 ] [ -4.44e-05 6.15e-05 6.3e-06 ] [ 1.07e-05 -7.6e-06 -3.65e-05 ] [ 2.53e-05 1.51e-05 -7.9e-06 ] [ -1.89e-05 -2.23e-05 5.81e-05 ] [ 4.47e-05 -1.37e-05 -7.8e-06 ] [ -1.96e-05 -8.1e-06 -4.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.68500622784e-15 -3.989419785791999e-14 5.879988198335999e-14 ] [ -7.113664196352e-14 9.853386217920001e-14 1.009371271104e-14 ] [ 1.714328984256e-14 -1.217654231808e-14 -5.84794466592e-14 ] [ 4.053506850624e-14 2.419286697408e-14 -1.265719530432e-14 ] [ -3.028113813312e-14 -3.572853864384e-14 9.308646166848001e-14 ] [ 7.161729494976001e-14 -2.194981970496e-14 -1.249697764224e-14 ] [ -3.140266176767999e-14 -1.297763062848e-14 -7.834643675712001e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }