{ "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" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4238426 0.5917439 -6.4759234 ] [ -2.5298054 -3.0776344 6.6999731 ] [ 0.9531817 -0.7139737 0.2851595 ] [ -1.4926776 0.3412984 -0.2178807 ] [ 1.6454587 2.8585658 -0.2913285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.281247325419086e-09 9.48078242081013e-10 -1.037557306957165e-08 ] [ -4.053195067053592e-09 -4.930913883049835e-09 1.07345402608089e-08 ] [ 1.5271654351144e-09 -1.143911970006073e-09 4.568758840990176e-10 ] [ -2.391533153111854e-09 5.468203171964468e-10 -3.490833636635385e-10 ] [ 2.636315459631961e-09 4.579927293778449e-09 -4.667597116727328e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.829464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.016812700299525e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0881169 2.9167926 1.1488792 ] [ 2.6442565 2.4360437 3.4230421 ] [ 1.8780776 4.4467767 2.4673539 ] [ 4.7307299 1.8837303 2.4822999 ] [ 4.1808372 4.1429188 2.852561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0881169e-10 2.9167926e-10 1.1488792e-10 ] [ 2.6442565e-10 2.4360437e-10 3.4230421e-10 ] [ 1.8780776e-10 4.4467767e-10 2.4673539e-10 ] [ 4.7307299e-10 1.8837303e-10 2.4822999e-10 ] [ 4.1808372e-10 4.142918800000001e-10 2.852561e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.87e-05 1.94e-05 -1.55e-05 ] [ -5.4e-06 -4.1e-06 1.01e-05 ] [ 1.09e-05 -1.35e-05 -5.4e-06 ] [ 1.4e-05 -2.27e-05 9.7e-06 ] [ -1e-06 2.09e-05 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.996070280896e-14 3.108222644352e-14 -2.48337376224e-14 ] [ -8.65175375232e-15 -6.568924145279999e-15 1.618198387008e-14 ] [ 1.746372516672e-14 -2.16293843808e-14 -8.65175375232e-15 ] [ 2.24304726912e-14 -3.636940929216e-14 1.554111322176e-14 ] [ -1.6021766208e-15 3.348549137472e-14 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245481754911e-18 } }