{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 5.517305 2.823831 2.520754 ] [ 3.206819 2.056835 2.580452 ] [ 4.931014 5.152147 1.608787 ] [ 3.498861 3.411494 1.086096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.517305000000001e-10 2.823831e-10 2.520754e-10 ] [ 3.206819e-10 2.056835e-10 2.580452e-10 ] [ 4.931014e-10 5.152147000000001e-10 1.608787e-10 ] [ 3.498861e-10 3.411494e-10 1.086096e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 9.0335687 -0.7304343 4.7953893 ] [ -2.7734636 -3.2728117 2.4486118 ] [ 1.1091338 0.6267226 0.3010479 ] [ -7.3692389 3.3765233 -7.5450489 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.447337269277375e-08 -1.170284768132146e-09 7.683060687393615e-09 ] [ -4.443578575169522e-09 -5.243622433221818e-09 3.923108611696681e-09 ] [ 1.777028258339629e-09 1.004120305719728e-09 4.823319110947685e-10 ] [ -1.180682237594386e-08 5.409786735416573e-09 -1.20885010499674e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.500493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.682364453008056e-18 } "relaxed-configuration-positions" { "source-value" [ [ 5.3201096 3.0560403 2.7693198 ] [ 3.3606574 1.7017193 2.498841 ] [ 5.2162715 5.0205125 1.3993219 ] [ 3.2569606 3.6660349 1.1286064 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.3201096e-10 3.0560403e-10 2.7693198e-10 ] [ 3.3606574e-10 1.7017193e-10 2.498841e-10 ] [ 5.2162715e-10 5.0205125e-10 1.3993219e-10 ] [ 3.2569606e-10 3.6660349e-10 1.1286064e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.17e-05 5.34e-05 4.21e-05 ] [ -2.66e-05 -4.38e-05 -4.55e-05 ] [ 6.9e-05 1.05e-05 -2.45e-05 ] [ -7.41e-05 -2.02e-05 2.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.078899929779999e-14 8.555623225559998e-14 6.745163629139998e-14 ] [ -4.26178984644e-14 -7.01753365692e-14 -7.289903684699999e-14 ] [ 1.10550187746e-13 1.6822854657e-14 -3.925332753299999e-14 ] [ -1.187212885794e-13 -3.236396800679999e-14 4.454051042519999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.092646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937455486443356e-18 } }