{ "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" [ [ 0.8594843 0.7172344 0.0157799 ] [ 0.2882733 0.8856534 2.226981 ] [ 1.449769 2.87204 1.321697 ] [ 2.751005 0.6869835 1.2059 ] [ 2.852604 2.214321 2.896583 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.594843e-11 7.172344000000001e-11 1.57799e-12 ] [ 2.882733e-11 8.856534000000001e-11 2.226981e-10 ] [ 1.449769e-10 2.87204e-10 1.321697e-10 ] [ 2.751005e-10 6.869835e-11 1.2059e-10 ] [ 2.852604e-10 2.214321e-10 2.896583e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3129997 0.2373287 7.9357074 ] [ 1.6604816 0.0579769 -6.9622589 ] [ -0.4603672 -0.1788145 0.4046169 ] [ -1.5245363 2.7389789 1.7729297 ] [ 0.0114221 -2.8554699 -3.1509951 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.014808016574138e-10 3.802424945848569e-10 1.271440486578955e-08 ] [ 2.660384798788577e-09 9.288923372645951e-11 -1.115476843753673e-08 ] [ -7.375895648231577e-10 -2.864924113600416e-10 6.482677375605715e-10 ] [ -2.442576417420935e-09 4.388327958444501e-09 2.840546515661958e-09 ] [ 1.830022158043968e-11 -4.574967115178114e-09 -5.048450681475358e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7974025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.249281598846747e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0917143 0.0789776 0.400402 ] [ -0.232278 1.5497917 1.3841654 ] [ 1.0314608 2.9175988 2.5741695 ] [ 3.1737512 0.5377527 0.9823734 ] [ 3.1364872 2.2921116 2.3258306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0917143e-10 7.89776e-12 4.00402e-11 ] [ -2.32278e-11 1.5497917e-10 1.3841654e-10 ] [ 1.0314608e-10 2.9175988e-10 2.5741695e-10 ] [ 3.1737512e-10 5.377527e-11 9.823734e-11 ] [ 3.1364872e-10 2.2921116e-10 2.3258306e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.9e-06 -2.53e-05 -2.78e-05 ] [ -4.68e-05 -8e-06 -1.1e-06 ] [ 4.4e-05 -5.2e-06 -6.5e-06 ] [ -2.56e-05 -6.2e-06 -2.9e-06 ] [ 2.04e-05 4.47e-05 3.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.265719530432e-14 -4.053506850624e-14 -4.454051005824e-14 ] [ -7.498186585344001e-14 -1.28174129664e-14 -1.76239428288e-15 ] [ 7.04957713152e-14 -8.33131842816e-15 -1.04141480352e-14 ] [ -4.101572149248001e-14 -9.93349504896e-15 -4.646312200320001e-15 ] [ 3.268440306432e-14 7.161729494976001e-14 6.136336457664001e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.370748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.821794660660836e-18 } }