{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3174303 -10.2618156 -10.2616939 ] [ -15.9647124 6.1828833 4.9655474 ] [ -5.3442364 -8.7102387 11.9484273 ] [ 1.2885743 4.6187041 -9.8365628 ] [ 2.9688647 2.6490645 6.3951288 ] [ 14.2756309 -8.3988713 -2.5412028 ] [ 5.0933093 13.9202737 -0.669644 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.71293264699353e-09 -1.644124104128073e-08 -1.644104605638597e-08 ] [ -2.557828896507586e-08 9.906071072394754e-09 7.955683953754227e-09 ] [ -8.562410616108357e-09 -1.395534080672738e-08 1.914349087538847e-08 ] [ 2.064523617623726e-09 7.399979727413106e-09 -1.575991094719098e-08 ] [ 4.756645612658406e-09 4.244269208891242e-09 1.024612585036476e-08 ] [ 2.287208207515006e-08 -1.34564752379681e-08 -4.071455714871499e-09 ] [ 8.160381082963213e-09 2.230273707727711e-08 -1.072887961058995e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.9865002 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.784900798454524e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6181685 1.6583976 1.5692038 ] [ 1.2335427 2.71528 3.3306512 ] [ 2.3061209 1.999831 5.3905676 ] [ 3.4023186 3.8691711 0.9286147 ] [ 4.38851 2.9073787 4.5229277 ] [ 4.5895209 1.1926447 2.8560657 ] [ 3.0712363 4.5627799 3.2340153 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6181685e-10 1.6583976e-10 1.5692038e-10 ] [ 1.2335427e-10 2.71528e-10 3.3306512e-10 ] [ 2.3061209e-10 1.999831e-10 5.3905676e-10 ] [ 3.4023186e-10 3.8691711e-10 9.286147e-11 ] [ 4.38851e-10 2.9073787e-10 4.5229277e-10 ] [ 4.5895209e-10 1.1926447e-10 2.8560657e-10 ] [ 3.0712363e-10 4.5627799e-10 3.2340153e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.22e-05 4.71e-05 2.73e-05 ] [ 1.09e-05 -1.76e-05 -4.62e-05 ] [ 1.93e-05 -1.7e-06 1.32e-05 ] [ -8.1e-06 9.3e-06 2.33e-05 ] [ -6.5e-06 2.93e-05 1.7e-06 ] [ -3.2e-06 -4.02e-05 1.5e-06 ] [ -3e-07 -2.62e-05 -2.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.954655477376e-14 7.546251883968001e-14 4.373942174784e-14 ] [ 1.746372516672e-14 -2.819830852608e-14 -7.402055988096e-14 ] [ 3.092200878144e-14 -2.72370025536e-15 2.114873139456e-14 ] [ -1.297763062848e-14 1.490024257344e-14 3.733071526464e-14 ] [ -1.04141480352e-14 4.694377498944e-14 2.72370025536e-15 ] [ -5.126965186560001e-15 -6.440750015616e-14 2.4032649312e-15 ] [ -4.8065298624e-16 -4.197702746496e-14 -3.348549137472e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }