{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.461444 -2.0115309 -3.1741908 ] [ 0.8044157 0.2703363 -0.0357463 ] [ -0.5532162 -0.6467903 1.2724729 ] [ -1.564217 -1.5458145 -2.0838649 ] [ 1.0612827 2.259112 2.1359131 ] [ -0.0187233 -0.272837 0.0168924 ] [ 2.7319022 1.9475244 1.8685235 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.943668030208435e-09 -3.222827779996782e-09 -5.085614289718449e-09 ] [ 1.288816027944467e-09 4.33126499613575e-10 -5.727188614010304e-11 ] [ -8.86350061887817e-10 -1.036272297220218e-09 2.038726330981576e-09 ] [ -2.506151907257914e-09 -2.476667851993641e-09 -3.33871962368573e-09 ] [ 1.7003623299995e-09 3.61949643016873e-09 3.422110032880452e-09 ] [ -2.999803352422464e-11 -4.371330626892096e-10 2.706460834920192e-11 ] [ 4.376989835152086e-09 3.120278062117548e-09 2.993704667115389e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.97722 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.399615172857818e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.819792 2.9540101 1.2713682 ] [ 2.2572392 1.1133315 2.5971992 ] [ 2.6601268 2.047228 4.6715112 ] [ 4.4753484 1.3928263 2.1235289 ] [ 4.8457594 2.5093963 4.0827459 ] [ 4.0804521 3.3352612 0.986204 ] [ 4.662076 4.4869584 2.9026014 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.819792e-10 2.9540101e-10 1.2713682e-10 ] [ 2.2572392e-10 1.1133315e-10 2.5971992e-10 ] [ 2.6601268e-10 2.047228e-10 4.6715112e-10 ] [ 4.4753484e-10 1.3928263e-10 2.1235289e-10 ] [ 4.845759400000001e-10 2.5093963e-10 4.0827459e-10 ] [ 4.0804521e-10 3.3352612e-10 9.86204e-11 ] [ 4.662076e-10 4.4869584e-10 2.9026014e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.46e-05 -2.82e-05 7.06e-05 ] [ -1.92e-05 3.73e-05 -5.1e-05 ] [ 1e-07 -5.3e-06 2e-07 ] [ 4.5e-06 8e-07 -2.77e-05 ] [ -1.07e-05 2.78e-05 1.91e-05 ] [ 1.53e-05 -1.78e-05 1.7e-05 ] [ -1.46e-05 -1.46e-05 -2.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.941354487168e-14 -4.518138070656001e-14 1.1311366942848e-13 ] [ -3.076179111936e-14 5.976118795584e-14 -8.17110076608e-14 ] [ 1.6021766208e-16 -8.491536090240001e-15 3.2043532416e-16 ] [ 7.2097947936e-15 1.28174129664e-15 -4.438029239616e-14 ] [ -1.714328984256e-14 4.454051005824e-14 3.060157345728e-14 ] [ 2.451330229824e-14 -2.851874385024e-14 2.72370025536e-14 ] [ -2.339177866368e-14 -2.339177866368e-14 -4.518138070656001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }