{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6406131 -1.8255487 1.0858279 ] [ 1.1514053 -0.3727678 -0.2195313 ] [ -0.7478112 -0.6766319 -1.5874887 ] [ -1.9210651 0.5714761 -0.0754422 ] [ -0.4015016 0.437125 -1.1554187 ] [ 1.906302 2.0425984 0.7313273 ] [ 0.6532836 -0.176251 1.2207256 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.026375331798212e-09 -2.924851447271833e-09 1.73968807559236e-09 ] [ 1.84475465272521e-09 -5.972398541470502e-10 -3.517279163938311e-10 ] [ -1.198125621412393e-09 -1.084083811067483e-09 -2.543437280924185e-09 ] [ -3.077885590254815e-09 9.156056467659629e-10 -1.208717290617178e-10 ] [ -6.432764767337934e-10 7.003514553672001e-10 -1.851184828375129e-09 ] [ 3.054232496584282e-09 3.272603402163487e-09 1.171715502212788e-09 ] [ 1.046675710672059e-09 -2.823852315926208e-10 1.955818016732052e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.780258 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.329364354179217e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3336149 2.0886974 1.64235 ] [ 3.0899345 4.3629117 1.2067883 ] [ 2.6878085 3.5417218 3.5767404 ] [ 5.1868023 3.1624273 1.5772213 ] [ 4.2330752 1.4774375 3.0312659 ] [ 4.6562007 5.052686 3.0334559 ] [ 4.8786149 3.2095042 4.6104742 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3336149e-10 2.0886974e-10 1.64235e-10 ] [ 3.0899345e-10 4.3629117e-10 1.2067883e-10 ] [ 2.6878085e-10 3.5417218e-10 3.5767404e-10 ] [ 5.1868023e-10 3.1624273e-10 1.5772213e-10 ] [ 4.2330752e-10 1.4774375e-10 3.0312659e-10 ] [ 4.6562007e-10 5.052686e-10 3.0334559e-10 ] [ 4.8786149e-10 3.2095042e-10 4.6104742e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.93e-05 -1.37e-05 -5.7e-06 ] [ 5.6e-06 -5.1e-06 1.8e-06 ] [ 1.27e-05 1.9e-06 6.6e-06 ] [ 1.64e-05 1.23e-05 -8e-06 ] [ -7.4e-06 1.3e-05 1e-06 ] [ -5.6e-06 4.4e-06 -9.8e-06 ] [ -2.3e-06 -1.28e-05 1.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.092200878144e-14 -2.194981970496e-14 -9.13240673856e-15 ] [ 8.972189076479999e-15 -8.17110076608e-15 2.88391791744e-15 ] [ 2.034764308416e-14 3.04413557952e-15 1.057436569728e-14 ] [ 2.627569658112e-14 1.970677243584e-14 -1.28174129664e-14 ] [ -1.185610699392e-14 2.08282960704e-14 1.6021766208e-15 ] [ -8.972189076479999e-15 7.04957713152e-15 -1.570133088384e-14 ] [ -3.68500622784e-15 -2.050786074624e-14 2.275090801536e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.08929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.539094400807123e-18 } }