{ "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" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.131117 0.7261441 -1.2603898 ] [ 3.0810658 2.1257128 -0.5641534 ] [ -1.0273924 0.9490912 -1.0912121 ] [ 0.1652073 -5.5877484 3.4657037 ] [ 1.7272543 -2.4424759 -0.8193254 ] [ 0.1901217 4.2552209 -3.5443104 ] [ -2.0051397 -0.0259448 3.8136874 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.414425861720178e-09 1.163411109936959e-09 -2.019367087291933e-09 ] [ 4.936411632576517e-09 3.405767378754715e-09 -9.038733954716555e-10 ] [ -1.646064097229182e-09 1.520611744175021e-09 -1.748314529358071e-09 ] [ 2.646912758262282e-10 -8.952559923150886e-09 5.552669488507346e-09 ] [ 2.767366480436026e-09 -3.91327781608812e-09 -1.312704011522704e-09 ] [ 3.046085453563578e-10 6.817615498488451e-09 -5.678611306523194e-09 ] [ -3.21258797524577e-09 -4.15681523338032e-11 6.110200841660211e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.182168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.272233818906251e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6972946 1.1058392 4.0797803 ] [ 1.9095494 5.4370541 1.913835 ] [ 3.1203307 3.2656962 1.4070949 ] [ 1.1772205 3.3184693 3.0297197 ] [ 3.7915181 1.3008054 2.7247455 ] [ 4.0831159 4.9186684 3.0393963 ] [ 3.2672978 3.0667044 4.4366234 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6972946e-10 1.1058392e-10 4.0797803e-10 ] [ 1.9095494e-10 5.4370541e-10 1.913835e-10 ] [ 3.1203307e-10 3.2656962e-10 1.4070949e-10 ] [ 1.1772205e-10 3.3184693e-10 3.0297197e-10 ] [ 3.7915181e-10 1.3008054e-10 2.7247455e-10 ] [ 4.0831159e-10 4.9186684e-10 3.0393963e-10 ] [ 3.2672978e-10 3.0667044e-10 4.4366234e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0035871 -0.0091067 0.0045584 ] [ -0.0044838 -0.002296 0.0010743 ] [ -0.0018838 -0.0041332 0.0002716 ] [ -0.0054891 0.0116727 -0.0059446 ] [ 0.0077763 0.0008283 -0.0046595 ] [ 0.0061917 -0.0020548 0.0033481 ] [ 0.0014759 0.0050897 0.0013517 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.7471678038214e-12 -1.45905419528478e-11 7.303361968425599e-12 ] [ -7.183839591529199e-12 -3.678597551663999e-12 1.7212183579062e-12 ] [ -3.018180343129199e-12 -6.622116463648799e-12 4.351511737943999e-13 ] [ -8.794507761689399e-12 1.87017271956918e-11 -9.524299218476399e-12 ] [ 1.24590061589742e-11 1.3270829059422e-12 -7.465342026122998e-12 ] [ 9.920197064737798e-12 -3.292152547543199e-12 5.364247588295399e-12 ] [ 2.3646524941206e-12 8.154598414069798e-12 2.1656621561778e-12 ] ] } "relaxed-potential-energy" { "source-value" -16.545614 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.650899614598328e-18 } }