{ "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" [ [ 2.301375 1.527111 2.019819 ] [ 1.794175 5.106546 1.47688 ] [ 0.9503771 3.237781 1.232452 ] [ 3.392468 3.669062 0.7528338 ] [ 3.101246 3.595776 2.776891 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.301375e-10 1.527111e-10 2.019819e-10 ] [ 1.794175e-10 5.106546e-10 1.47688e-10 ] [ 9.503771e-11 3.237781e-10 1.232452e-10 ] [ 3.392468e-10 3.669062e-10 7.528338e-11 ] [ 3.101246e-10 3.595776e-10 2.776891e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7618772 0.9196191 -0.5869879 ] [ 0.7577531 3.2851969 0.7019154 ] [ -1.1497333 -2.5557856 -0.4055001 ] [ 0.351229 -1.5848276 -3.1636924 ] [ -0.7211261 -0.0642028 3.454265 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.220661837760566e-09 1.473392222061137e-09 -9.404582900724882e-10 ] [ 1.214054301158725e-09 5.263465667904635e-09 1.12459244365948e-09 ] [ -1.842075813415233e-09 -4.094819936097301e-09 -6.49682779952062e-10 ] [ 5.627308923469632e-10 -2.539173728718574e-09 -5.068793998682642e-09 ] [ -1.155371378068683e-09 -1.028642251498983e-10 5.534342625047712e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.707463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.157483647388103e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5875242 1.5950164 1.8405787 ] [ 2.0283312 5.2594951 1.4629733 ] [ 0.9148368 3.1862555 1.3760094 ] [ 3.2604971 3.4613321 0.5718283 ] [ 2.7484519 3.6341769 3.0074861 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5875242e-10 1.5950164e-10 1.8405787e-10 ] [ 2.0283312e-10 5.2594951e-10 1.4629733e-10 ] [ 9.148368000000001e-11 3.1862555e-10 1.3760094e-10 ] [ 3.2604971e-10 3.4613321e-10 5.718283e-11 ] [ 2.7484519e-10 3.6341769e-10 3.0074861e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.4e-06 -2.93e-05 -4.2e-06 ] [ 3.5e-06 5.7e-06 -8.6e-06 ] [ 6.4e-06 6.9e-06 -1.1e-06 ] [ -1.62e-05 8.9e-06 1.42e-05 ] [ -1e-07 7.9e-06 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.025393037312e-14 -4.694377498944e-14 -6.72914180736e-15 ] [ 5.6076181728e-15 9.13240673856e-15 -1.377871893888e-14 ] [ 1.025393037312e-14 1.105501868352e-14 -1.76239428288e-15 ] [ -2.595526125696e-14 1.425937192512e-14 2.275090801536e-14 ] [ -1.6021766208e-16 1.265719530432e-14 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }