{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.84187 2.347102 1.383115 ] [ 2.042679 1.03426 3.627522 ] [ 0.9834518 3.478775 3.226301 ] [ 4.103178 1.51668 2.106844 ] [ 3.482715 3.397853 2.716774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84187e-10 2.347102e-10 1.383115e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ 9.834518e-11 3.478775e-10 3.226301e-10 ] [ 4.103178e-10 1.51668e-10 2.106844e-10 ] [ 3.482715e-10 3.397853e-10 2.716774e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1708185 -1.5182612 -1.1963548 ] [ -0.2642247 0.5228626 -0.8982703 ] [ 0.4645208 -0.4666607 1.1050172 ] [ 0.816198 -5.7995568 -1.2390938 ] [ -0.8456755 7.2616161 2.2287017 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.73681409354929e-10 -2.432522618948801e-09 -1.916771706533743e-09 ] [ -4.233346404656597e-10 8.377182405124883e-10 -1.43918768567617e-09 ] [ 7.442443717669872e-10 -7.476728695460837e-10 1.770432738008105e-09 ] [ 1.307693364317532e-09 -9.291914392515811e-09 -1.985247133694269e-09 ] [ -1.354921526046267e-09 1.163439164049821e-08 3.570773787896077e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.746065 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.042144751844521e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9104027 2.2732587 1.3223297 ] [ 1.8281731 0.9299225 3.3895296 ] [ 1.2937244 3.2970702 3.4801367 ] [ 3.9780264 1.4536357 2.3889902 ] [ 3.4435672 3.8207829 2.4795699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9104027e-10 2.2732587e-10 1.3223297e-10 ] [ 1.8281731e-10 9.299225e-11 3.3895296e-10 ] [ 1.2937244e-10 3.2970702e-10 3.4801367e-10 ] [ 3.9780264e-10 1.4536357e-10 2.3889902e-10 ] [ 3.4435672e-10 3.8207829e-10 2.4795699e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-07 -5e-07 -4.8e-06 ] [ -7.2e-06 7.3e-06 1.2e-06 ] [ -6.7e-06 4.9e-06 7.8e-06 ] [ 1.91e-05 3.8e-06 -5e-06 ] [ -4.4e-06 -1.56e-05 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2817413072e-15 -8.010883169999999e-16 -7.690447843199998e-15 ] [ -1.15356717648e-14 1.16958894282e-14 1.9226119608e-15 ] [ -1.07345834478e-14 7.850665506599998e-15 1.24969777452e-14 ] [ 3.06015737094e-14 6.088271209199999e-15 -8.010883169999999e-15 ] [ -7.0495771896e-15 -2.49939554904e-14 1.2817413072e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.391586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.305786281540152e-18 } }