{ "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" [ [ 0.049795 0.7119441 0.3423404 ] [ 0.1447331 1.623908 1.772641 ] [ 2.54973 0.1092944 1.824085 ] [ 1.77811 2.382187 0.8238028 ] [ 2.019176 2.140924 2.983896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.9795e-12 7.119441e-11 3.423404e-11 ] [ 1.447331e-11 1.623908e-10 1.772641e-10 ] [ 2.54973e-10 1.092944e-11 1.824085e-10 ] [ 1.77811e-10 2.382187e-10 8.238028e-11 ] [ 2.019176e-10 2.140924e-10 2.983896e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4957487 -15.1832877 -20.4271316 ] [ -16.3541906 9.5744666 20.5970375 ] [ 6.8049125 -8.2354625 0.9073215 ] [ 9.9929462 11.1627951 -11.3914723 ] [ 5.0520806 2.6814885 10.3142448 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.805160080931993e-09 -2.432630857982021e-08 -3.27278726795249e-08 ] [ -2.620230183142712e-08 1.533998654315046e-08 3.300009194024088e-08 ] [ 1.090267171408968e-08 -1.319466547897512e-08 1.453689294849187e-09 ] [ 1.60104647745522e-08 1.78847693320008e-08 -1.82511505955508e-08 ] [ 8.094325423717236e-09 4.29621818364406e-09 1.652524187976797e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.2394717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.190205821483232e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5529121 0.6717873 0.2789747 ] [ -0.3508344 1.642308 2.3946269 ] [ 2.2928173 -0.176592 1.8561988 ] [ 1.9829419 2.7152344 0.397237 ] [ 2.0637072 2.1155198 2.8197278 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.529121e-11 6.717873e-11 2.789747e-11 ] [ -3.508344e-11 1.642308e-10 2.3946269e-10 ] [ 2.2928173e-10 -1.76592e-11 1.8561988e-10 ] [ 1.9829419e-10 2.7152344e-10 3.97237e-11 ] [ 2.0637072e-10 2.1155198e-10 2.8197278e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.2e-06 -7.9e-06 -1.28e-05 ] [ -1.99e-05 1.24e-05 4.1e-06 ] [ 1.62e-05 -5.3e-06 -4e-06 ] [ -1e-07 -1.5e-06 -3.7e-06 ] [ 1e-05 2.3e-06 1.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.93349504896e-15 -1.265719530432e-14 -2.050786074624e-14 ] [ -3.188331475392e-14 1.986699009792e-14 6.568924145279999e-15 ] [ 2.595526125696e-14 -8.491536090240001e-15 -6.4087064832e-15 ] [ -1.6021766208e-16 -2.4032649312e-15 -5.928053496960001e-15 ] [ 1.6021766208e-14 3.68500622784e-15 2.64359142432e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }