{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5645904 -0.8871723 -0.2634685 ] [ -6.5521471 -2.334501 7.1623167 ] [ -0.8132066 1.4366402 -1.0376582 ] [ 0.59585 -3.2666292 -0.813889 ] [ 0.9592917 -2.7028547 -0.0980076 ] [ 5.5206069 5.5272444 -7.1832064 ] [ 0.8541956 2.2272726 2.2339131 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.045735466607135e-10 -1.421406729392038e-09 -4.22123074495029e-10 ] [ -1.049769698615086e-08 -3.740282954249634e-09 1.147529646204799e-08 ] [ -1.302900613134584e-09 2.301751359905087e-09 -1.662511722118499e-09 ] [ 9.546569473689e-10 -5.233716976182113e-09 -1.303993938469626e-09 ] [ 1.536954746930138e-09 -4.330450645437079e-09 -1.570254866744184e-10 ] [ 8.844987380679174e-09 8.855621828087348e-09 -1.150876545127926e-08 ] [ 1.36857223118561e-09 3.568484117268428e-09 3.579123371206505e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.734526 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.040296000226549e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.593419 1.4237777 0.6857039 ] [ 3.0969541 4.7190115 4.3521887 ] [ 0.9451122 3.700658 0.8852308 ] [ 3.5941422 1.870818 1.8949573 ] [ 4.1164413 1.1388576 4.0383588 ] [ 2.9370776 4.1783566 2.0972201 ] [ 3.8168416 2.8700096 5.5501374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593419e-10 1.4237777e-10 6.857039000000001e-11 ] [ 3.0969541e-10 4.719011499999999e-10 4.3521887e-10 ] [ 9.451122e-11 3.700658e-10 8.852308e-11 ] [ 3.5941422e-10 1.870818e-10 1.8949573e-10 ] [ 4.1164413e-10 1.1388576e-10 4.0383588e-10 ] [ 2.9370776e-10 4.1783566e-10 2.0972201e-10 ] [ 3.8168416e-10 2.8700096e-10 5.550137399999999e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.1e-06 6.3e-06 -2.63e-05 ] [ 4.5e-06 1.86e-05 -6.1e-06 ] [ -1.9e-05 6.9e-06 1.85e-05 ] [ 7e-06 -1.04e-05 3.1e-06 ] [ 1.21e-05 -2.71e-05 1.75e-05 ] [ -3.9e-06 -2.4e-06 -4.8e-06 ] [ -7.7e-06 8.2e-06 -2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.13754541014e-14 1.00937127942e-14 -4.21372454742e-14 ] [ 7.209794853e-15 2.98004853924e-14 -9.773277467399999e-15 ] [ -3.0441356046e-14 1.10550187746e-14 2.9640267729e-14 ] [ 1.1215236438e-14 -1.66626369936e-14 4.9667475654e-15 ] [ 1.93863372714e-14 -4.34189867814e-14 2.8038091095e-14 ] [ -6.248488872599999e-15 -3.845223921599999e-15 -7.690447843199998e-15 ] [ -1.23367600818e-14 1.31378483988e-14 -3.204353268e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.517349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.966806389142326e-18 } }