{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.536743 -3.8462526 -12.2773835 ] [ -3.3757085 1.0608734 5.246229 ] [ -0.7308075 -2.0668124 0.888531 ] [ -2.0554063 4.8949319 1.2617965 ] [ 12.6986652 -0.0427403 4.880827 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.047301681077806e-08 -6.162375993411214e-09 -1.967053680829568e-08 ] [ -5.408481237335837e-09 1.699706559108607e-09 8.405385451162962e-09 ] [ -1.170882690805296e-09 -3.311398506859538e-09 1.423583595056045e-09 ] [ -3.293123920105031e-09 7.842545450588123e-09 2.021620852507267e-09 ] [ 2.034550449880656e-08 -6.847750942597825e-11 7.819946909569402e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.01234623 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.978084106101958e-21 } "relaxed-configuration-positions" { "source-value" [ [ 1.9046212 1.5701178 0.2508712 ] [ 1.4276365 4.1881112 2.7255669 ] [ 3.5135737 0.1831856 0.8533362 ] [ 1.7716239 5.8350215 1.9179506 ] [ 4.2136616 1.9378937 1.9961952 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9046212e-10 1.5701178e-10 2.508712e-11 ] [ 1.4276365e-10 4.1881112e-10 2.7255669e-10 ] [ 3.5135737e-10 1.831856e-11 8.533362e-11 ] [ 1.7716239e-10 5.8350215e-10 1.9179506e-10 ] [ 4.2136616e-10 1.9378937e-10 1.9961952e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.88e-05 -7.1e-06 1.74e-05 ] [ -6.5e-06 -3.13e-05 1.54e-05 ] [ -2.14e-05 -1.5e-05 -2.05e-05 ] [ 6.5e-06 3.13e-05 -1.54e-05 ] [ -7.4e-06 2.21e-05 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.614268667904e-14 -1.137545400768e-14 2.787787320192e-14 ] [ -1.04141480352e-14 -5.014812823104e-14 2.467351996032e-14 ] [ -3.428657968511999e-14 -2.4032649312e-14 -3.28446207264e-14 ] [ 1.04141480352e-14 5.014812823104e-14 -2.467351996032e-14 ] [ -1.185610699392e-14 3.540810331968e-14 4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.135307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.065814150723059e-18 } }