{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 26.4446198 -41.8470203 -25.6031936 ] [ -103.9417793 43.5529836 6.0361098 ] [ -8.141003 24.9654156 -30.5462084 ] [ 66.2203964 5.2614925 -55.5653094 ] [ 19.4177661 -31.9328714 105.6786016 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.236895158950478e-08 -6.7046317574803e-08 -4.102083820373619e-08 ] [ -1.665330887188134e-07 6.977957209000582e-08 9.670914002141764e-09 ] [ -1.304332467646266e-08 3.999900520287561e-08 -4.894042095256458e-08 ] [ 1.060967709321885e-07 8.429840274014545e-09 -8.902543964819847e-08 ] [ 3.11106908735828e-08 -5.116209999209296e-08 1.693157848023575e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 37.28807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.974207398875385e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0445742 1.8400337 1.4006393 ] [ 2.4153724 4.1834991 2.9559391 ] [ 5.7663684 2.0164026 2.3319846 ] [ 5.1811483 4.9079632 2.2198609 ] [ 4.4316667 3.0151963 4.7686111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0445742e-10 1.8400337e-10 1.4006393e-10 ] [ 2.4153724e-10 4.1834991e-10 2.9559391e-10 ] [ 5.766368400000001e-10 2.0164026e-10 2.3319846e-10 ] [ 5.181148300000001e-10 4.9079632e-10 2.2198609e-10 ] [ 4.4316667e-10 3.0151963e-10 4.7686111e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 8.7e-06 4.6e-06 ] [ -1.09e-05 9.5e-06 -6.4e-06 ] [ 1.93e-05 4.1e-06 6.8e-06 ] [ -3.3e-06 -5e-06 -1.29e-05 ] [ 2.3e-06 -1.74e-05 7.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.169588933184e-14 1.393893660096e-14 7.370012455680001e-15 ] [ -1.746372516672e-14 1.52206778976e-14 -1.025393037312e-14 ] [ 3.092200878144e-14 6.568924145279999e-15 1.089480102144e-14 ] [ -5.28718284864e-15 -8.010883104e-15 -2.066807840832e-14 ] [ 3.68500622784e-15 -2.787787320192e-14 1.265719530432e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }