{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7431384 2.7965466 0.7811306 ] [ 3.6313136 -2.6528546 -2.5853723 ] [ -0.2202504 0.2058138 0.6258602 ] [ -2.8623235 -4.9341103 1.1064467 ] [ 3.7817905 -0.5317927 2.9542257 ] [ 2.1252575 4.1261646 -0.4774501 ] [ -2.7126493 0.9902326 -2.4048407 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.997168832898718e-09 4.48056158149773e-09 1.251509185111476e-09 ] [ 5.818005752713083e-09 -4.250341618501735e-09 -4.142223055123924e-09 ] [ -3.528800416018483e-10 3.29750058598007e-10 1.002738580329212e-09 ] [ -4.585947792866429e-09 -7.905316167108475e-09 1.772723034901311e-09 ] [ 6.059096323863543e-09 -8.520258310521082e-10 4.733191349106515e-09 ] [ 3.405037879679856e-09 6.610844455692584e-09 -7.64959387818622e-10 ] [ -4.346143288889485e-09 1.586527520873998e-09 -3.852979546288307e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9234239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.589907777086796e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9697215 3.5439189 2.9189216 ] [ 5.9065958 1.5588204 1.3698395 ] [ 3.6346306 1.5115153 1.0107263 ] [ 3.4017604 1.8144973 3.4202532 ] [ 5.50274 2.8279248 3.2462211 ] [ 4.9170322 4.6220798 1.9786025 ] [ 3.0869245 3.7838639 0.9217228 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9697215e-10 3.5439189e-10 2.9189216e-10 ] [ 5.9065958e-10 1.5588204e-10 1.3698395e-10 ] [ 3.6346306e-10 1.5115153e-10 1.0107263e-10 ] [ 3.4017604e-10 1.8144973e-10 3.4202532e-10 ] [ 5.50274e-10 2.8279248e-10 3.2462211e-10 ] [ 4.9170322e-10 4.6220798e-10 1.9786025e-10 ] [ 3.0869245e-10 3.7838639e-10 9.217228e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.27e-05 1.21e-05 -3e-06 ] [ -6e-05 1.26e-05 -2.6e-06 ] [ 5.33e-05 2.4e-05 3.05e-05 ] [ -4.2e-06 -3.16e-05 1.26e-05 ] [ -4.4e-06 7.6e-06 -4.78e-05 ] [ 6.8e-06 -4.2e-06 9.7e-06 ] [ 3.13e-05 -2.05e-05 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.636940929216e-14 1.938633711168e-14 -4.8065298624e-15 ] [ -9.6130597248e-14 2.018742542208e-14 -4.16565921408e-15 ] [ 8.539601388864e-14 3.84522388992e-14 4.88663869344e-14 ] [ -6.72914180736e-15 -5.062878121728e-14 2.018742542208e-14 ] [ -7.04957713152e-15 1.217654231808e-14 -7.658404247424001e-14 ] [ 1.089480102144e-14 -6.72914180736e-15 1.554111322176e-14 ] [ 5.014812823104e-14 -3.28446207264e-14 8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }