{ "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" [ [ 2.819728 1.352428 1.364201 ] [ 2.130711 2.142985 3.535598 ] [ 2.900765 3.536828 2.247591 ] [ 4.867849 2.542824 1.805581 ] [ 4.180951 2.552465 4.619841 ] [ 3.604443 0.2919785 5.062878 ] [ 4.799237 0.5958561 3.34882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.819728e-10 1.352428e-10 1.364201e-10 ] [ 2.130711e-10 2.142985e-10 3.535598e-10 ] [ 2.900765e-10 3.536828e-10 2.247591e-10 ] [ 4.867849e-10 2.542824e-10 1.805581e-10 ] [ 4.180951e-10 2.552465e-10 4.619841e-10 ] [ 3.604443e-10 2.919785e-11 5.062878e-10 ] [ 4.799237e-10 5.958561e-11 3.34882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6743148 -2.9380891 -1.2859549 ] [ -3.5693206 -2.7687293 3.6113007 ] [ -0.1509144 5.8918078 -1.1818721 ] [ 4.0003907 -0.8420321 -0.9489846 ] [ 0.4178925 2.4873228 0.7189562 ] [ -2.556815 -2.0787885 3.2055632 ] [ 2.5330816 0.2485084 -4.1190085 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.080371416520383e-09 -4.707337704630089e-09 -2.060326893157806e-09 ] [ -5.718682064574861e-09 -4.435993390331176e-09 5.785941599887843e-09 ] [ -2.417915254141296e-10 9.439716789178944e-09 -1.893567862996511e-09 ] [ 6.409332506410903e-09 -1.349084155697951e-09 -1.520440952145836e-09 ] [ 6.695375990238449e-10 3.985130471375455e-09 1.151894824509431e-09 ] [ -4.09646925046071e-09 -3.330586361727908e-09 5.135878457850269e-09 ] [ 4.058444151535334e-09 3.981543518327255e-10 -6.599379173947388e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.096055064916392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.418654669058639e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6164852 1.3899357 1.1237838 ] [ 2.14549 1.6017928 3.6338425 ] [ 3.0565437 3.5214604 2.0766433 ] [ 5.2123746 2.4598144 2.6595319 ] [ 4.0343502 3.0609193 4.7488415 ] [ 4.063617 0.7083007 5.0793853 ] [ 4.1748232 0.2731414 2.6624815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6164852e-10 1.3899357e-10 1.1237838e-10 ] [ 2.14549e-10 1.6017928e-10 3.6338425e-10 ] [ 3.056543700000001e-10 3.5214604e-10 2.0766433e-10 ] [ 5.212374600000001e-10 2.4598144e-10 2.6595319e-10 ] [ 4.034350200000001e-10 3.0609193e-10 4.7488415e-10 ] [ 4.063617e-10 7.083007e-11 5.079385300000001e-10 ] [ 4.1748232e-10 2.731414e-11 2.6624815e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.16e-05 1.2e-06 3.96e-05 ] [ 0.0001066 3.4e-05 -2.74e-05 ] [ 5.81e-05 -0.0001061 7.85e-05 ] [ -1.46e-05 -1.9e-06 3.65e-05 ] [ -7.57e-05 4.62e-05 -2.9e-05 ] [ -6.6e-06 1.14e-05 -0.0001026 ] [ -2.62e-05 1.53e-05 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.665054797439999e-14 1.9226119608e-15 6.34461947064e-14 ] [ 1.707920291844e-13 5.447400555599999e-14 -4.389963977159999e-14 ] [ 9.308646243539999e-14 -1.699909408674e-13 1.25770865769e-13 ] [ -2.33917788564e-14 -3.0441356046e-15 5.847944714099999e-14 ] [ -1.212847711938e-13 7.40205604908e-14 -4.6463122386e-14 ] [ -1.05743657844e-14 1.82648136276e-14 -1.643833226484e-13 ] [ -4.197702781079999e-14 2.45133025002e-14 7.0495771896e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.180097064916392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.912772672126102e-18 } }