{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.2601153 11.0562196 -10.4306028 ] [ 6.2065262 -2.4304054 15.0788269 ] [ 13.9165634 -5.5750909 -3.1626314 ] [ -9.4781734 9.7373993 -9.9962621 ] [ 4.6151991 -12.7881225 8.5106694 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.444939996437238e-08 1.771401655755073e-08 -1.671166794701102e-08 ] [ 9.943951174022666e-09 -3.893938710946072e-09 2.415894392827014e-08 ] [ 2.229679252136096e-08 -8.93228029881483e-09 -5.067094089287974e-09 ] [ -1.518570782936845e-08 1.560103350585429e-08 -1.601577743200911e-08 ] [ 7.394364098357201e-09 -2.048883089342645e-08 1.363559554003796e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.262220970765052 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.445277362084325e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3036659 1.1982495 1.0356647 ] [ 0.6197013 0.0019922 2.8406997 ] [ 1.7748509 0.0979183 0.7782662 ] [ 1.6757314 2.4602861 0.8594893 ] [ 2.5990925 1.2640382 2.6645316 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.036659e-11 1.1982495e-10 1.0356647e-10 ] [ 6.197013e-11 1.9922e-13 2.8406997e-10 ] [ 1.7748509e-10 9.79183e-12 7.782662e-11 ] [ 1.6757314e-10 2.4602861e-10 8.594893e-11 ] [ 2.5990925e-10 1.2640382e-10 2.6645316e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 -1.09e-05 -7.4e-06 ] [ -5.8e-06 3.8e-06 -6e-06 ] [ -1.25e-05 8.7e-06 6.1e-06 ] [ -6.4e-06 3.3e-06 -4e-06 ] [ 2.35e-05 -4.8e-06 1.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.76239428288e-15 -1.746372516672e-14 -1.185610699392e-14 ] [ -9.292624400640001e-15 6.08827115904e-15 -9.6130597248e-15 ] [ -2.002720776e-14 1.393893660096e-14 9.77327738688e-15 ] [ -1.025393037312e-14 5.28718284864e-15 -6.4087064832e-15 ] [ 3.76511505888e-14 -7.69044777984e-15 1.826481347712e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }