{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.22663 4.731229 3.098836 ] [ 1.847326 3.342651 1.125175 ] [ 3.745505 4.563816 1.476664 ] [ 4.096158 4.449552 3.85515 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.22663e-10 4.731229e-10 3.098836e-10 ] [ 1.847326e-10 3.342651e-10 1.125175e-10 ] [ 3.745505e-10 4.563816e-10 1.476664e-10 ] [ 4.096158e-10 4.449552e-10 3.85515e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.6471309 1.2839284 0.4144131 ] [ 4.3113897 2.399541 0.0575047 ] [ -3.6966714 -2.8836477 -6.2670915 ] [ 5.0324125 -0.7998217 5.7951737 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.047701102577263e-09 2.057080065261151e-09 6.639629801732525e-10 ] [ 6.907607780497927e-09 3.844488490851053e-09 9.213268592611776e-11 ] [ -5.922720491860005e-09 -4.620112927563692e-09 -1.00409874817144e-08 ] [ 8.062813653721681e-09 -1.281455628548511e-09 9.284891815615033e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8009115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.69190816382986e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.4184055 5.0928529 3.1766817 ] [ 1.7108968 2.8973193 -0.0536809 ] [ 2.583674 4.4470504 1.245659 ] [ 4.2026428 4.6500255 5.1871652 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4184055e-10 5.0928529e-10 3.1766817e-10 ] [ 1.7108968e-10 2.8973193e-10 -5.36809e-12 ] [ 2.583674e-10 4.4470504e-10 1.245659e-10 ] [ 4.2026428e-10 4.6500255e-10 5.187165200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1908367 -0.1075875 0.4547784 ] [ 0.1314817 0.2852275 0.1531409 ] [ -0.1894037 -0.3204777 -0.254501 ] [ -0.1329146 0.1428378 -0.3534183 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.057540991306233e-10 -1.7237417719032e-10 7.286353201248308e-10 ] [ 2.106569058030394e-10 4.56984832109232e-10 2.453587696682707e-10 ] [ -3.03458180033017e-10 -5.134618784277562e-10 -4.077555521702208e-10 ] [ -2.129526646829837e-10 2.288513837265062e-10 -5.662385376228806e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.3796646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.342570271226538e-18 } }