{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1034103 -4.868982 -12.57671 ] [ -24.2752118 -0.250566 15.6377267 ] [ 10.3063188 -8.390495 1.7179867 ] [ 7.1164384 1.7065872 -25.7513515 ] [ 9.9558648 11.8034559 20.9723482 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.97221146837493e-09 -7.800969191766587e-09 -2.015011089459414e-08 ] [ -3.889317713136108e-08 -4.01450990474844e-10 2.505440032761793e-08 ] [ 1.651254316391492e-08 -1.344305503669383e-08 2.752518148262768e-09 ] [ 1.140179132178034e-08 2.734254135723484e-09 -4.125821366722085e-08 ] [ 1.595105395382308e-08 1.891122124342944e-08 3.360140624615196e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.364560046368851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.788442855982129e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.28428 0.5138137 0.7457747 ] [ -0.1394196 1.8083406 2.5785264 ] [ 1.8944418 0.40298 2.3696989 ] [ 1.6264224 2.3597164 0.9222415 ] [ 1.9365369 2.5428697 3.182801 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8428e-11 5.138137e-11 7.457747e-11 ] [ -1.394196e-11 1.8083406e-10 2.5785264e-10 ] [ 1.8944418e-10 4.0298e-11 2.3696989e-10 ] [ 1.6264224e-10 2.3597164e-10 9.222415000000001e-11 ] [ 1.9365369e-10 2.5428697e-10 3.182801e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -6.08e-05 -1.21e-05 ] [ -4.2e-05 9.68e-05 -0.0001553 ] [ 4.54e-05 0.0001087 -0.0001444 ] [ -0.0001325 -0.0001793 0.0002238 ] [ 0.0001255 3.47e-05 8.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.767835882399999e-15 -9.741233934719999e-14 -1.93863372714e-14 ] [ -6.729141862799998e-14 1.550906981712e-13 -2.488180312602e-13 ] [ 7.273881918359998e-14 1.741566001158e-13 -2.313543059496e-13 ] [ -2.12288404005e-13 -2.872702704762e-13 3.585671306892e-13 ] [ 2.01073167567e-13 5.55955291998e-14 1.411517614554e-13 ] ] } "relaxed-potential-energy" { "source-value" -12.924216046368851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.070687696226003e-18 } }