{ "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" [ [ 1.127389 1.171603 0.6946463 ] [ 1.009133 1.283908 2.574652 ] [ 0.7652821 2.93985 0.2651139 ] [ 0.0212665 2.421916 2.924129 ] [ 2.909562 0.955426 0.4927479 ] [ 2.967895 0.4293313 2.317144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.127389e-10 1.171603e-10 6.946463000000001e-11 ] [ 1.009133e-10 1.283908e-10 2.574652e-10 ] [ 7.652821e-11 2.93985e-10 2.651139e-11 ] [ 2.12665e-12 2.421916e-10 2.924129e-10 ] [ 2.909562e-10 9.55426e-11 4.927479e-11 ] [ 2.967895e-10 4.293313e-11 2.317144e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.770986 -17.1307985 -9.1855567 ] [ 27.4113328 -33.7447724 4.7505748 ] [ -5.2835363 16.4904348 1.5322476 ] [ -30.2776504 37.6299895 5.9557221 ] [ 16.3553433 -0.2687442 -8.2840025 ] [ 2.5654965 -2.9761091 5.2310147 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.725702209434112e-08 -2.744656507846225e-08 -1.471688431502215e-08 ] [ 4.391779691895779e-08 -5.40650858589281e-08 7.611259942629222e-09 ] [ -8.465158404750813e-09 2.642058932106046e-08 2.454931302222578e-09 ] [ -4.851014400330075e-08 6.028988991456534e-08 9.54211878721741e-09 ] [ 2.620414887630845e-08 -4.305756777630227e-10 -1.327243524149758e-08 ] [ 4.110378546908781e-09 -4.768252460254768e-09 8.38100952445052e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.5973847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.763645709849099e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9160512 0.952884 0.1294494 ] [ 0.8080881 0.6519483 2.7415375 ] [ 0.3565983 3.2040468 0.683986 ] [ 0.274596 2.9753781 2.6688554 ] [ 3.263614 0.8232495 0.5298709 ] [ 3.18158 0.5945276 2.5147339 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.160512e-11 9.52884e-11 1.294494e-11 ] [ 8.080881e-11 6.519483e-11 2.7415375e-10 ] [ 3.565983e-11 3.2040468e-10 6.83986e-11 ] [ 2.74596e-11 2.9753781e-10 2.6688554e-10 ] [ 3.263614e-10 8.232495e-11 5.298709e-11 ] [ 3.18158e-10 5.945276e-11 2.5147339e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.15e-05 1.89e-05 1.85e-05 ] [ -8.18e-05 -2.27e-05 4.49e-05 ] [ 4.1e-05 -3.18e-05 3.39e-05 ] [ 1.16e-05 -1.26e-05 -2.57e-05 ] [ 7.55e-05 -1.91e-05 3.31e-05 ] [ -1.49e-05 6.73e-05 -0.0001047 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.046856397099999e-14 3.02811383826e-14 2.9640267729e-14 ] [ -1.310580486612e-13 -3.636940959179999e-14 7.193773086659999e-14 ] [ 6.568924199399999e-14 -5.09492169612e-14 5.431378789259999e-14 ] [ 1.85852489544e-14 -2.01874255884e-14 -4.11759394938e-14 ] [ 1.20964335867e-13 -3.06015737094e-14 5.303204658539999e-14 ] [ -2.38724318466e-14 1.078264874682e-13 -1.677478935798e-13 ] ] } "relaxed-potential-energy" { "source-value" -14.836346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.377044689513936e-18 } }