{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.1530722 -29.9639785 -7.7117922 ] [ -32.7182462 0.4982684 -39.8122228 ] [ -34.7462847 32.0371237 11.2949306 ] [ 63.0153739 -50.580052 36.8748674 ] [ 2.8286942 8.1574877 -15.2662337 ] [ 12.773535 39.8511508 14.6204508 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.786919152893442e-08 -4.800758581885385e-08 -1.23556531673078e-08 ] [ -5.242040913521844e-08 7.983139813634228e-10 -6.378621259224071e-08 ] [ -5.566968500600074e-08 5.13291305898176e-08 1.809647374087852e-08 ] [ 1.009617588135505e-07 -8.103817679324828e-08 5.908005044338008e-08 ] [ 4.532067714632559e-09 1.306973607740357e-08 -2.445920272180908e-08 ] [ 2.046545914197053e-08 6.384858212373522e-08 2.342454445731666e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 36.908497 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.913393100226694e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7339462 -0.5578532 1.393869 ] [ -1.5978573 3.4721207 1.0201911 ] [ 0.3519429 2.7323583 1.7259074 ] [ 3.1410283 1.6916364 3.8518736 ] [ 3.6609471 2.3506622 0.3502277 ] [ 2.2267619 1.5554622 1.8390293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7339462e-10 -5.578532000000001e-11 1.393869e-10 ] [ -1.5978573e-10 3.4721207e-10 1.0201911e-10 ] [ 3.519429e-11 2.7323583e-10 1.7259074e-10 ] [ 3.1410283e-10 1.6916364e-10 3.8518736e-10 ] [ 3.6609471e-10 2.3506622e-10 3.502277e-11 ] [ 2.2267619e-10 1.5554622e-10 1.8390293e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.023646 0.0357886 0.0087249 ] [ 0.1638647 -0.0495334 0.0746582 ] [ -0.2116759 0.0804655 -0.0722951 ] [ -0.0366877 0.0025946 -0.046855 ] [ -0.0082397 -0.0138688 0.0103176 ] [ 0.0690925 -0.0554464 0.0254495 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.78850683754368e-11 5.733965821116288e-11 1.397883079881792e-11 ] [ 2.625401913144058e-10 -7.936125542873471e-11 1.196156225910105e-10 ] [ -3.391421781667987e-10 1.289199428809824e-10 -1.158295190183981e-10 ] [ -5.878017521092415e-11 4.15700746032768e-12 -7.506998556758399e-11 ] [ -1.320145470240576e-11 -2.222026711855104e-11 1.653061750276608e-11 ] [ 1.10698388172624e-10 -8.883492578752512e-11 4.077459391104961e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.178126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.790933214155662e-18 } }