{ "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" [ [ 0.4264597 0.3568663 1.24612 ] [ 0.1993437 1.82063 0.3429825 ] [ 0.3583889 1.799016 2.47518 ] [ 1.901803 0.1168384 0.4528213 ] [ 1.669099 0.8043485 2.197104 ] [ 2.479285 2.402454 1.01494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.264597e-11 3.568663e-11 1.24612e-10 ] [ 1.993437e-11 1.82063e-10 3.429825e-11 ] [ 3.583889e-11 1.799016e-10 2.47518e-10 ] [ 1.901803e-10 1.168384e-11 4.528213e-11 ] [ 1.669099e-10 8.043485000000001e-11 2.197104e-10 ] [ 2.479285e-10 2.402454e-10 1.01494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -71.2035397 -83.3145631 -27.5091691 ] [ -11.2756065 33.4203249 -39.7903081 ] [ -39.2697148 71.6359873 62.6402868 ] [ 44.5462988 -34.1512639 -75.1124899 ] [ 72.2196034 4.8668296 78.5077289 ] [ 4.9829589 7.5426852 1.2639515 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.140806466255446e-07 -1.334846451709864e-07 -4.407454758965378e-08 ] [ -1.806551311964051e-08 5.35452632143201e-08 -6.375110137224886e-08 ] [ -6.291701895804375e-08 1.147735040599857e-07 1.003608030311668e-07 ] [ 7.13710384805311e-08 -5.471635659135103e-08 -1.203434752478561e-07 ] [ 1.157085601309282e-07 7.797520602537415e-09 1.257832477956845e-07 ] [ 7.983580251987285e-09 1.208471388549417e-08 2.025073543125091e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 64.430255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.032286482331823e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.6483221 -0.2135566 0.9494278 ] [ -1.1146254 1.4766395 0.4547555 ] [ -0.1808978 2.8839034 2.4635767 ] [ 2.618307 0.3294586 -0.4766605 ] [ 1.5112346 1.0869758 2.805887 ] [ 3.5520387 1.7367325 1.5321613 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.483221000000001e-11 -2.135566e-11 9.494278000000001e-11 ] [ -1.1146254e-10 1.4766395e-10 4.547555e-11 ] [ -1.808978e-11 2.8839034e-10 2.4635767e-10 ] [ 2.618307e-10 3.294586e-11 -4.766605e-11 ] [ 1.5112346e-10 1.0869758e-10 2.805887e-10 ] [ 3.5520387e-10 1.7367325e-10 1.5321613e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.27e-05 -2.54e-05 -1.21e-05 ] [ 7.3e-06 5.6e-06 1.76e-05 ] [ -1.23e-05 2.2e-05 6e-06 ] [ 2.57e-05 1.23e-05 -4e-07 ] [ -2.24e-05 7.9e-06 1.85e-05 ] [ -1.11e-05 -2.25e-05 -2.96e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.034764308416e-14 -4.069528616832e-14 -1.938633711168e-14 ] [ 1.169588933184e-14 8.972189076479999e-15 2.819830852608e-14 ] [ -1.970677243584e-14 3.52478856576e-14 9.6130597248e-15 ] [ 4.117593915456e-14 1.970677243584e-14 -6.408706483200001e-16 ] [ -3.588875630592e-14 1.265719530432e-14 2.96402674848e-14 ] [ -1.778416049088e-14 -3.604897396800001e-14 -4.742442797568e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.238735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.761949818916669e-18 } }