{ "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" [ [ 0.8442817 0.9206702 0.8357587 ] [ 0.3795063 0.7207018 2.571138 ] [ 0.5352031 2.484454 2.60301 ] [ 2.861465 0.7370648 0.0976718 ] [ 2.459453 1.267265 1.961226 ] [ 1.563309 2.840378 0.3371872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.442817e-11 9.206702e-11 8.357587e-11 ] [ 3.795063e-11 7.207018e-11 2.571138e-10 ] [ 5.352031e-11 2.484454e-10 2.60301e-10 ] [ 2.861465e-10 7.370648e-11 9.767180000000001e-12 ] [ 2.459453e-10 1.267265e-10 1.961226e-10 ] [ 1.563309e-10 2.840378e-10 3.371872000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3319719 -2.760796 -3.5104385 ] [ -1.6404677 -2.9593457 2.6787591 ] [ -0.131408 3.1378877 0.2354449 ] [ 2.0587751 -0.7227276 -2.9822874 ] [ 3.3685844 0.9894212 4.0349453 ] [ 0.676488 2.3155605 -0.4564234 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.940584157324585e-09 -4.423282842440664e-09 -5.624342539794009e-09 ] [ -2.628319017771722e-09 -4.741394532468374e-09 4.291845238134869e-09 ] [ -2.10538827120672e-10 5.027450353056001e-09 3.772243173744666e-10 ] [ 3.298521359881013e-09 -1.157937273466898e-09 -4.778151188152611e-09 ] [ 5.397067215336909e-09 1.585227527824241e-09 6.46469507912812e-09 ] [ 1.083853266781392e-09 3.709936927713357e-09 -7.312709066908355e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.145681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.106170293621775e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4856284 0.5375356 0.2155525 ] [ 0.3910681 0.5730473 2.5334641 ] [ 1.0815956 2.850769 2.5267558 ] [ 2.8016718 1.0792144 0.3017319 ] [ 2.707115 1.1146977 2.6196457 ] [ 1.1761393 2.8152698 0.2088417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.856284e-11 5.375356e-11 2.155525e-11 ] [ 3.910681e-11 5.730473000000001e-11 2.5334641e-10 ] [ 1.0815956e-10 2.850769e-10 2.5267558e-10 ] [ 2.8016718e-10 1.0792144e-10 3.017319e-11 ] [ 2.707115e-10 1.1146977e-10 2.6196457e-10 ] [ 1.1761393e-10 2.8152698e-10 2.088417e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.16e-05 2.12e-05 -3.71e-05 ] [ -2.95e-05 -4.09e-05 4.81e-05 ] [ -2.39e-05 2.92e-05 2.02e-05 ] [ 2.83e-05 -3.15e-05 -3e-05 ] [ 5.13e-05 -5.4e-06 4.24e-05 ] [ -1.46e-05 2.73e-05 -4.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.85852489544e-14 3.39661446408e-14 -5.94407531214e-14 ] [ -4.726421070299999e-14 -6.552902433059999e-14 7.706469609539999e-14 ] [ -3.82920215526e-14 4.67835577128e-14 3.236396800679999e-14 ] [ 4.53415987422e-14 -5.046856397099999e-14 -4.806529901999999e-14 ] [ 8.21916613242e-14 -8.6517538236e-15 6.79322892816e-14 ] [ -2.33917788564e-14 4.37394221082e-14 -7.001511890579999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031399002736e-18 } }