{ "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" [ [ 0.9136055 0.1992462 0.0711002 ] [ 0.7203108 0.3740979 2.589381 ] [ 1.027468 2.872573 2.429267 ] [ 2.566191 2.896163 0.5924317 ] [ 2.633567 2.125326 2.686178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.136055e-11 1.992462e-11 7.11002e-12 ] [ 7.203108000000001e-11 3.740979e-11 2.589381e-10 ] [ 1.027468e-10 2.872573e-10 2.429267e-10 ] [ 2.566191e-10 2.896163e-10 5.924317e-11 ] [ 2.633567e-10 2.125326e-10 2.686178e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4973635 0.0003497 4.6744229 ] [ 1.2708326 1.3990203 -4.7665032 ] [ -21.3088525 8.4987483 -2.0001317 ] [ 0.9909609 1.4774664 -4.2324484 ] [ 19.5444225 -11.3755847 6.3246604 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.968641783044589e-10 5.602811689097999e-13 7.489251147814518e-09 ] [ 2.036098297445468e-09 2.24147763515167e-09 -7.636780052926229e-09 ] [ -3.414054557285248e-08 1.361649594450722e-08 -3.204564274662697e-09 ] [ 1.58769439918761e-09 2.367162143600098e-09 -6.781129931090685e-09 ] [ 3.131361705452386e-08 -1.82256960044279e-08 1.013322311086509e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.0670968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.91403082717617e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2916175 -0.8862474 0.6378535 ] [ 1.061661 0.8751953 1.8918011 ] [ 0.4517584 3.1639823 1.6576258 ] [ 2.7230994 3.8016287 1.9734479 ] [ 3.3330059 1.5128472 2.2076294 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.916175e-11 -8.862474000000001e-11 6.378535e-11 ] [ 1.061661e-10 8.751953e-11 1.8918011e-10 ] [ 4.517584e-11 3.1639823e-10 1.6576258e-10 ] [ 2.7230994e-10 3.8016287e-10 1.9734479e-10 ] [ 3.3330059e-10 1.5128472e-10 2.2076294e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.81e-05 -5.13e-05 -1.92e-05 ] [ 4.2e-05 6.77e-05 -7.1e-06 ] [ -3.82e-05 -1.76e-05 3e-06 ] [ 2.51e-05 -9.5e-06 6.9e-06 ] [ 9.2e-06 1.07e-05 1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.10429297554e-14 -8.21916613242e-14 -3.076179137279999e-14 ] [ 6.729141862799998e-14 1.084673581218e-13 -1.13754541014e-14 ] [ -6.12031474188e-14 -2.81983087584e-14 4.806529901999999e-15 ] [ 4.02146335134e-14 -1.5220678023e-14 1.10550187746e-14 ] [ 1.47400250328e-14 1.71432899838e-14 2.62756967976e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.301703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.81073244710077e-18 } }