{ "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" [ [ 2.841627 2.849258 1.50686 ] [ 0.998489 4.149663 3.105849 ] [ 4.765797 1.647113 1.498592 ] [ 3.299037 1.906995 3.475865 ] [ 3.256514 4.175642 3.223298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.841627e-10 2.849258e-10 1.50686e-10 ] [ 9.98489e-11 4.149663e-10 3.105849e-10 ] [ 4.765797e-10 1.647113e-10 1.498592e-10 ] [ 3.299037e-10 1.906995e-10 3.475865e-10 ] [ 3.256514e-10 4.175642e-10 3.223298000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.3352522 0.6148362 -16.0733408 ] [ -5.1187154 1.4912404 1.0651394 ] [ 5.2331066 -2.908656 -1.212645 ] [ 1.6458054 -9.8188348 10.1610206 ] [ 4.5750555 10.6214143 6.0598258 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.015019304533709e-08 9.850761933773508e-10 -2.575233106007886e-08 ] [ -8.201086209975963e-09 2.389230524556813e-09 1.70654145863278e-09 ] [ 8.384361117751184e-09 -4.660180679543903e-09 -1.94287148433693e-09 ] [ 2.636870955991023e-09 -1.573150768966606e-08 1.627974978291266e-08 ] [ 7.330047021353187e-09 1.701738181149346e-08 9.708911302870356e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.2421836 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.0001080709058e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.372457 2.910726 0.725886 ] [ 0.924476 4.4596408 3.8623926 ] [ 5.5038999 1.4511318 2.2741652 ] [ 3.2061346 1.7405514 2.9878618 ] [ 3.1544965 4.1666209 2.9601584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.372457e-10 2.910726e-10 7.258860000000001e-11 ] [ 9.24476e-11 4.4596408e-10 3.8623926e-10 ] [ 5.503899900000001e-10 1.4511318e-10 2.2741652e-10 ] [ 3.2061346e-10 1.7405514e-10 2.9878618e-10 ] [ 3.1544965e-10 4.1666209e-10 2.9601584e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.34e-05 -8.5e-06 4.8e-06 ] [ 1.15e-05 -1.02e-05 -1.95e-05 ] [ 3.72e-05 -8.8e-06 -3.73e-05 ] [ -5.07e-05 -1.7e-06 3.04e-05 ] [ -1.13e-05 2.93e-05 2.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.14691668956e-14 -1.3618501389e-14 7.690447843199998e-15 ] [ 1.8425031291e-14 -1.63422016668e-14 -3.1242444363e-14 ] [ 5.96009707848e-14 -1.40991543792e-14 -5.97611884482e-14 ] [ -8.123035534379999e-14 -2.7237002778e-15 4.870616967359999e-14 ] [ -1.81045959642e-14 4.69437753762e-14 3.46070152944e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.457292 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835660553131513e-18 } }