{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3913569 -14.2234643 -17.0388679 ] [ 12.1455515 -17.9049383 11.9223551 ] [ -7.2824261 15.1726957 3.3425185 ] [ -41.0258128 19.8373614 22.7219912 ] [ 6.6544125 -15.6300431 -6.9101166 ] [ 1.1380736 29.1822427 -51.2090311 ] [ 25.9788444 -16.4338541 37.1711508 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.831376148734674e-09 -2.278850215599316e-08 -2.729927601919265e-08 ] [ 1.945931882034365e-08 -2.868687377747168e-08 1.910171876347073e-08 ] [ -1.166773293625175e-08 2.430933852533227e-08 5.355305039412729e-09 ] [ -6.573059865901811e-08 3.178295691529353e-08 3.640464337859361e-08 ] [ 1.066154422049753e-08 -2.504208984323292e-08 -1.107122735473552e-08 ] [ 1.823394929692262e-09 4.675510738165707e-08 -8.20459130781993e-08 ] [ 4.162269747600175e-08 -2.63299370455851e-08 5.95547492706504e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.7179972763671643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.752535093471111e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3913569 -14.2234643 -17.0388679 ] [ 12.1455515 -17.9049383 11.9223551 ] [ -7.2824261 15.1726957 3.3425185 ] [ -41.0258128 19.8373614 22.7219912 ] [ 6.6544125 -15.6300431 -6.9101166 ] [ 1.1380736 29.1822427 -51.2090311 ] [ 25.9788444 -16.4338541 37.1711508 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.831376148734674e-09 -2.278850215599316e-08 -2.729927601919265e-08 ] [ 1.945931882034365e-08 -2.868687377747168e-08 1.910171876347073e-08 ] [ -1.166773293625175e-08 2.430933852533227e-08 5.355305039412729e-09 ] [ -6.573059865901811e-08 3.178295691529353e-08 3.640464337859361e-08 ] [ 1.066154422049753e-08 -2.504208984323292e-08 -1.107122735473552e-08 ] [ 1.823394929692262e-09 4.675510738165707e-08 -8.20459130781993e-08 ] [ 4.162269747600175e-08 -2.63299370455851e-08 5.95547492706504e-08 ] ] } "relaxed-potential-energy" { "source-value" -1.7179972763671643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.752535093471111e-19 } }