{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1807825 -2.9942108 -3.0557038 ] [ -4.2120348 -5.4205579 4.3483428 ] [ 3.6798784 -0.6321203 0.1002604 ] [ 1.274776 7.2808581 -2.2759116 ] [ -3.0344457 14.2893946 7.9004994 ] [ 3.4375031 -5.5771832 1.1130272 ] [ -0.9648944 -6.9461805 -8.1305143 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.89645494949776e-10 -4.797254541506865e-09 -4.895777188449719e-09 ] [ -6.748423682556003e-09 -8.684691139072745e-09 6.966813173384011e-09 ] [ 5.895815139866911e-09 -1.012768366193082e-09 1.606348688720563e-10 ] [ 2.042416303956941e-09 1.166522062718231e-08 -3.646412356527522e-09 ] [ -4.86171795762709e-09 2.289413395350577e-08 1.265799543132443e-08 ] [ 5.507487100747524e-09 -8.935632532958532e-09 1.783266158154486e-09 ] [ -1.545931249220844e-09 -1.112900800095686e-08 -1.302651992654008e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9392638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.432227946752377e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7846695 2.0015501 2.1781525 ] [ 0.6126715 1.4762035 4.3184369 ] [ 2.2224247 1.443765 5.8323608 ] [ 2.5810388 2.7105174 1.1266964 ] [ 5.4621195 1.4163016 3.5079154 ] [ 4.6908685 2.3410641 1.6649047 ] [ 4.3736925 1.2480409 5.4205893 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.846695e-11 2.0015501e-10 2.1781525e-10 ] [ 6.126715000000001e-11 1.4762035e-10 4.3184369e-10 ] [ 2.2224247e-10 1.443765e-10 5.832360800000001e-10 ] [ 2.5810388e-10 2.7105174e-10 1.1266964e-10 ] [ 5.4621195e-10 1.4163016e-10 3.5079154e-10 ] [ 4.6908685e-10 2.3410641e-10 1.6649047e-10 ] [ 4.3736925e-10 1.2480409e-10 5.4205893e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.5065919 -0.2518207 1.2412313 ] [ 0.6811035 0.3135296 -0.3082506 ] [ -1.1253129 -0.1235074 -0.5804653 ] [ 1.0925908 -0.1118227 -0.162355 ] [ -0.1489126 0.0366963 0.7339778 ] [ -0.7663231 0.1827254 -0.4515825 ] [ 0.7734462 -0.0458005 -0.4725557 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.116496984666516e-10 -4.034612381734906e-10 1.988671769865191e-09 ] [ 1.091248104045053e-09 5.023297950487757e-10 -4.938719046675724e-10 ] [ -1.802950019464648e-09 -1.978806687757939e-10 -9.300079328456581e-10 ] [ 1.750523435861169e-09 -1.791597156147321e-10 -2.60121385269984e-10 ] [ -2.385842862625421e-10 5.879395392986304e-11 1.175962071346218e-09 ] [ -1.227784954798981e-09 2.927583639063284e-10 -7.23514923862416e-10 ] [ 1.239197419086601e-09 -7.33804903209504e-11 -7.571176945657786e-10 ] ] } "relaxed-potential-energy" { "source-value" -18.099689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899889855955094e-18 } }