{ "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" [ [ 0.438828 2.90963 1.106787 ] [ 1.47463 4.835343 1.863436 ] [ 2.314132 3.251036 2.795551 ] [ 3.696872 4.248886 0.9164855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.38828e-11 2.90963e-10 1.106787e-10 ] [ 1.47463e-10 4.835343e-10 1.863436e-10 ] [ 2.314132e-10 3.251036e-10 2.795551e-10 ] [ 3.696872e-10 4.248886e-10 9.164855e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3532665 -1.6609366 -0.5212991 ] [ -3.4282802 9.3323481 -4.1012949 ] [ 4.2166753 -7.8984865 4.6234408 ] [ 0.5648714 0.227075 -0.0008467 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.168171948011843e-09 -2.661113789151042e-09 -8.352132304640813e-10 ] [ -5.492710385991549e-09 1.49520699429873e-08 -6.570998803786275e-09 ] [ 6.755858583164827e-09 -1.265477041000442e-08 7.407568757412849e-09 ] [ 9.050237508385652e-10 3.6381425616816e-10 -1.35656294483136e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0035059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.016500175014864e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0545465 2.9703336 1.7843669 ] [ 1.4696587 4.9070093 1.1088795 ] [ 2.4925699 2.7154454 2.2322664 ] [ 3.9076869 4.6521067 1.5567467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.45465e-12 2.9703336e-10 1.7843669e-10 ] [ 1.4696587e-10 4.907009300000001e-10 1.1088795e-10 ] [ 2.4925699e-10 2.7154454e-10 2.2322664e-10 ] [ 3.9076869e-10 4.6521067e-10 1.5567467e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 -2e-07 2.1e-06 ] [ -7e-07 1e-05 -6.6e-06 ] [ 4.9e-06 -1e-05 3.2e-06 ] [ -3.9e-06 3e-07 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-16 -3.2043532416e-16 3.36457090368e-15 ] [ -1.12152363456e-15 1.6021766208e-14 -1.057436569728e-14 ] [ 7.850665441919999e-15 -1.6021766208e-14 5.126965186560001e-15 ] [ -6.24848882112e-15 4.8065298624e-16 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.6024309 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.21804370492275e-18 } }