{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.93382 1.245152 2.813835 ] [ 2.031103 3.253162 4.119437 ] [ 5.029042 2.355016 2.700294 ] [ 3.923156 2.081195 4.901301 ] [ 3.286942 3.48059 1.880825 ] [ 4.655074 4.019286 4.063597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.93382e-10 1.245152e-10 2.813835e-10 ] [ 2.031103e-10 3.253162e-10 4.119437e-10 ] [ 5.029042e-10 2.355016e-10 2.700294e-10 ] [ 3.923156e-10 2.081195e-10 4.901301000000001e-10 ] [ 3.286942e-10 3.48059e-10 1.880825e-10 ] [ 4.655074e-10 4.019286e-10 4.063597e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5543174 -3.5229115 -0.8348898 ] [ -2.4826007 1.7186518 -0.0034182 ] [ 7.0901653 -5.3509785 -3.0199298 ] [ 0.5162289 -4.7717896 4.8074712 ] [ -3.2452312 3.7349124 -3.0009304 ] [ 0.6757551 8.1921154 2.051697 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.092467654099631e-09 -5.64432648894989e-09 -1.337640929524933e-09 ] [ -3.977564833092043e-09 2.753583755942041e-09 -5.476560170338799e-12 ] [ 1.13596971748576e-08 -8.573212721736368e-09 -4.838460961880293e-09 ] [ 8.270898813755224e-10 -7.645249799484207e-09 7.70241802526794e-09 ] [ -5.19943360056778e-09 5.98398937731686e-09 -4.808020567140273e-09 ] [ 1.082679031526333e-09 1.312521587691156e-08 3.287180993447898e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7491871 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.561991977211422e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7946898 1.1891973 2.7806489 ] [ 2.0170423 3.3338694 4.1371221 ] [ 5.2693367 2.1442642 2.6893075 ] [ 4.0405309 1.8636804 5.0250479 ] [ 3.2458481 3.6144533 1.8013818 ] [ 4.4916893 4.2889363 4.0457808 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7946898e-10 1.1891973e-10 2.7806489e-10 ] [ 2.0170423e-10 3.3338694e-10 4.1371221e-10 ] [ 5.269336700000001e-10 2.1442642e-10 2.6893075e-10 ] [ 4.0405309e-10 1.8636804e-10 5.0250479e-10 ] [ 3.2458481e-10 3.6144533e-10 1.8013818e-10 ] [ 4.4916893e-10 4.2889363e-10 4.0457808e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 0.0 0.0 ] [ -3e-07 2e-07 1e-07 ] [ 3e-07 -0.0 -0.0 ] [ 0.0 1e-07 -4e-07 ] [ 1e-07 -2e-07 3e-07 ] [ -1e-07 -1e-07 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-16 0.0 0.0 ] [ -4.806529901999999e-16 3.204353268e-16 1.602176634e-16 ] [ 4.806529901999999e-16 0.0 0.0 ] [ 0.0 1.602176634e-16 -6.408706536e-16 ] [ 1.602176634e-16 -3.204353268e-16 4.806529901999999e-16 ] [ -1.602176634e-16 -1.602176634e-16 0.0 ] ] } "relaxed-potential-energy" { "source-value" -13.135352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104515405376517e-18 } }