{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9642193 -4.1852998 2.8013643 ] [ 0.1386435 0.9521341 -1.9896208 ] [ -0.2824497 -1.1451928 -0.6352299 ] [ 3.9505164 4.095867 -0.1573675 ] [ -0.8424909 0.2824915 -0.0191461 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.749202900511836e-09 -6.705589545844873e-09 4.488280424781766e-09 ] [ 2.22131376155979e-10 1.525487007454619e-09 -3.187723956280387e-09 ] [ -4.525343096203098e-10 -1.834801145585035e-09 -1.017750502998157e-09 ] [ 6.329425068313797e-09 6.562302403371677e-09 -2.52130531450995e-10 ] [ -1.34981923433763e-09 4.52601280603611e-10 -3.067543405222739e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -12.477822 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.999167485161115e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5974391 2.5461047 3.9451305 ] [ 1.9890915 3.3729181 1.5665639 ] [ 0.5392096 4.6227777 3.1275229 ] [ 2.9746087 4.6514981 3.538517 ] [ 3.8348811 2.4242344 2.9059527 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5974391e-10 2.5461047e-10 3.9451305e-10 ] [ 1.9890915e-10 3.3729181e-10 1.5665639e-10 ] [ 5.392096e-11 4.6227777e-10 3.1275229e-10 ] [ 2.9746087e-10 4.651498100000001e-10 3.538517e-10 ] [ 3.8348811e-10 2.4242344e-10 2.9059527e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.67e-05 -1.4e-06 2.34e-05 ] [ 6.1e-06 5.2e-06 -1.59e-05 ] [ -1.9e-06 1.05e-05 5e-06 ] [ -1.2e-05 -1.63e-05 -6.8e-06 ] [ 2.45e-05 2e-06 -5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.67563497878e-14 -2.2430472876e-15 3.749093323559999e-14 ] [ 9.773277467399999e-15 8.331318496799998e-15 -2.54746084806e-14 ] [ -3.0441356046e-15 1.6822854657e-14 8.010883169999999e-15 ] [ -1.9226119608e-14 -2.61154791342e-14 -1.08948011112e-14 ] [ 3.925332753299999e-14 3.204353268e-15 -8.972189150399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }