{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.2245392 -7.0291754 -12.0101463 ] [ -25.2343696 -7.164337 15.1509653 ] [ 8.2826557 -29.8607391 8.4297175 ] [ 16.5323145 19.6297976 -21.8225125 ] [ 9.6439386 24.4244539 10.2519761 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.477934116565705e-08 -1.12619805821676e-08 -1.924237577278155e-08 ] [ -4.042991734683992e-08 -1.147853333950166e-08 2.42745225862048e-08 ] [ 1.327027743000691e-08 -4.784217845999019e-08 1.350589640972089e-08 ] [ 2.648768799783939e-08 3.145040304486927e-08 -3.496351962267292e-08 ] [ 1.545129308465067e-08 3.913228933679017e-08 1.642547655974645e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.64099503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.026987259576129e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.159404 0.3341778 0.5522488 ] [ -0.1691358 1.7877168 2.6184056 ] [ 1.9383288 0.3749043 2.3752924 ] [ 1.5921646 2.4140054 0.8857319 ] [ 2.0815 2.7169161 3.3673637 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.59404e-11 3.341778e-11 5.522488e-11 ] [ -1.691358e-11 1.7877168e-10 2.6184056e-10 ] [ 1.9383288e-10 3.749043e-11 2.3752924e-10 ] [ 1.5921646e-10 2.4140054e-10 8.857319e-11 ] [ 2.0815e-10 2.7169161e-10 3.3673637e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.93e-05 -2.25e-05 1.93e-05 ] [ 2.23e-05 1.1e-06 -4.35e-05 ] [ 2.9e-06 -5.6e-06 1.22e-05 ] [ -1.21e-05 3.98e-05 -1.14e-05 ] [ 6.2e-06 -1.28e-05 2.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.09220090362e-14 -3.6048974265e-14 3.09220090362e-14 ] [ 3.572853893819999e-14 1.7623942974e-15 -6.969468357899999e-14 ] [ 4.6463122386e-15 -8.972189150399999e-15 1.95465549348e-14 ] [ -1.93863372714e-14 6.376663003319999e-14 -1.82648136276e-14 ] [ 9.9334951308e-15 -2.05078609152e-14 3.765115089899999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.756113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844842935926364e-18 } }