{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3601931 -0.0492182 0.6654632 ] [ -0.2338945 -0.393674 -1.0421507 ] [ -2.279061 0.7196321 0.7990146 ] [ -7.1996697 3.3513894 -1.9914176 ] [ 2.2518704 -3.8395051 3.6169164 ] [ 3.2548632 -4.9792872 -6.8470746 ] [ 3.8456985 5.190663 4.7992487 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.770929637934765e-10 -7.885624935785856e-11 1.066189581042755e-09 ] [ -3.747402996337056e-10 -6.307352790168192e-10 -1.669709486890355e-09 ] [ -3.651458251577069e-09 1.152977726197208e-09 1.280162511797864e-09 ] [ -1.153514247082215e-08 5.36951774387694e-09 -3.190602720969646e-09 ] [ 3.607894107951545e-09 -6.151565306662366e-09 5.794938895468101e-09 ] [ 5.214865722942275e-09 -7.977697540088695e-09 -1.097022284499351e-08 ] [ 6.161488227345629e-09 8.31635890505159e-09 7.689244064544793e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.675335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.710377215620797e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.038358 3.0898148 1.2563138 ] [ 1.6589156 1.4549811 2.8039282 ] [ 1.1344536 3.1537381 4.3996749 ] [ 1.5338473 4.723946 2.7913539 ] [ 3.4845337 2.360634 4.2280827 ] [ 4.2124719 3.0443229 1.9512442 ] [ 3.6880078 4.7430761 3.5469956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.038358e-10 3.0898148e-10 1.2563138e-10 ] [ 1.6589156e-10 1.4549811e-10 2.8039282e-10 ] [ 1.1344536e-10 3.1537381e-10 4.3996749e-10 ] [ 1.5338473e-10 4.723946e-10 2.7913539e-10 ] [ 3.4845337e-10 2.360634e-10 4.2280827e-10 ] [ 4.2124719e-10 3.0443229e-10 1.9512442e-10 ] [ 3.6880078e-10 4.7430761e-10 3.5469956e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-06 -3.4e-06 3.8e-06 ] [ -1.1e-06 1.86e-05 1.3e-06 ] [ 5.6e-06 -7.9e-06 -8.8e-06 ] [ 1.11e-05 -9.2e-06 7e-07 ] [ 4e-07 -5.3e-06 8.1e-06 ] [ -1.74e-05 1.14e-05 6.8e-06 ] [ -3.6e-06 -4.2e-06 -1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-15 -5.44740051072e-15 6.08827115904e-15 ] [ -1.76239428288e-15 2.980048514688e-14 2.08282960704e-15 ] [ 8.972189076479999e-15 -1.265719530432e-14 -1.409915426304e-14 ] [ 1.778416049088e-14 -1.474002491136e-14 1.12152363456e-15 ] [ 6.408706483200001e-16 -8.491536090240001e-15 1.297763062848e-14 ] [ -2.787787320192e-14 1.826481347712e-14 1.089480102144e-14 ] [ -5.76783583488e-15 -6.72914180736e-15 -1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }