{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.91701 1.98827 2.508844 ] [ 2.572173 1.794465 4.860558 ] [ 4.363165 1.510923 1.91691 ] [ 4.651171 2.095892 4.214607 ] [ 5.448722 3.893309 2.444809 ] [ 3.326625 3.729664 3.343147 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.91701e-10 1.98827e-10 2.508844e-10 ] [ 2.572173e-10 1.794465e-10 4.860558000000001e-10 ] [ 4.363165000000001e-10 1.510923e-10 1.91691e-10 ] [ 4.651171e-10 2.095892e-10 4.214607e-10 ] [ 5.448722e-10 3.893309e-10 2.444809e-10 ] [ 3.326625e-10 3.729664e-10 3.343147e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.8422771 1.8525151 4.7199431 ] [ -0.5755619 2.8693791 -6.1742975 ] [ -2.9908368 6.3121959 6.7892983 ] [ -0.4988655 2.8958455 -7.4060616 ] [ -5.1450037 -5.4361696 2.7350472 ] [ 1.3679907 -8.493766 -0.6639293 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.256471302345522e-08 2.968056382898974e-09 7.562182486326276e-09 ] [ -9.221518200032275e-10 4.597252110232146e-09 -9.892315104363887e-09 ] [ -4.791848797588285e-09 1.011325269688961e-08 1.087765500789719e-08 ] [ -7.992706410237024e-10 4.639655957548886e-09 -1.186581874772464e-08 ] [ -8.243204642069497e-09 -8.709703839823687e-09 4.382028680624501e-09 ] [ 2.191762717011827e-09 -1.360851330774593e-08 -1.063732002324109e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.78813 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.452149222175111e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8940886 2.1610764 2.3884525 ] [ 2.8569817 1.6232855 4.3140256 ] [ 4.0501518 1.686113 2.4478648 ] [ 4.9128655 2.4458753 4.3422352 ] [ 5.2843702 3.5175769 2.43497 ] [ 3.2804082 3.5785961 3.3613268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8940886e-10 2.1610764e-10 2.3884525e-10 ] [ 2.8569817e-10 1.6232855e-10 4.3140256e-10 ] [ 4.0501518e-10 1.686113e-10 2.4478648e-10 ] [ 4.9128655e-10 2.4458753e-10 4.3422352e-10 ] [ 5.284370199999999e-10 3.5175769e-10 2.43497e-10 ] [ 3.2804082e-10 3.5785961e-10 3.3613268e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.51e-05 2.16e-05 -2e-06 ] [ 4.8e-05 6.84e-05 -1.8e-05 ] [ -0.0001027 -1.76e-05 -2.37e-05 ] [ 3.24e-05 1.49e-05 1.85e-05 ] [ 3.66e-05 1.58e-05 3.07e-05 ] [ -6.94e-05 -0.000103 -5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.827993180608e-14 3.460701500928e-14 -3.2043532416e-15 ] [ 7.69044777984e-14 1.0958888086272e-13 -2.88391791744e-14 ] [ -1.6454353895616e-13 -2.819830852608e-14 -3.797158591296e-14 ] [ 5.191052251392001e-14 2.387243164992e-14 2.96402674848e-14 ] [ 5.863966432128e-14 2.531439060864e-14 4.918682225856e-14 ] [ -1.1119105748352e-13 -1.650241919424e-13 -8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }