{ "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" [ [ -11.1942758 1.0591172 -11.9727868 ] [ -11.7461115 -12.3602138 -0.1187285 ] [ -9.3872092 2.8595263 16.5048925 ] [ 7.8647777 -13.4402623 -8.5366469 ] [ 14.423647 -2.237692 11.1619675 ] [ 2.6541988 8.8462806 -12.0268412 ] [ 7.384973 15.2732441 4.9881433 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.793520697354722e-08 1.696892816527158e-09 -1.918251909678285e-08 ] [ -1.881934523061002e-08 -1.980324557844953e-08 -1.902240269226528e-10 ] [ -1.503996711479867e-08 4.581466184422727e-09 2.644375289231726e-08 ] [ 1.26007629587292e-08 -2.153367403447964e-08 -1.36772160832048e-08 ] [ 2.310923001007206e-08 -3.585177806951194e-09 1.788344337062942e-08 ] [ 4.252495264315415e-09 1.41733039583566e-08 -1.926912379271422e-08 ] [ 1.183203108583924e-08 2.447043462079154e-08 7.991886576460162e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 135.38791 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.169153441409746e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.0853475 4.0591582 -0.9823853 ] [ -1.3389456 -4.7153178 3.7559109 ] [ -0.5534871 3.5742978 9.2937306 ] [ 6.9473515 -2.5549973 -1.4784312 ] [ 9.1154873 0.6029528 7.7588053 ] [ 6.6784127 7.1489074 -4.6769694 ] [ 6.0373227 9.7240107 4.9644978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.0853475e-10 4.0591582e-10 -9.823853e-11 ] [ -1.3389456e-10 -4.7153178e-10 3.7559109e-10 ] [ -5.534871e-11 3.5742978e-10 9.293730600000001e-10 ] [ 6.9473515e-10 -2.5549973e-10 -1.4784312e-10 ] [ 9.1154873e-10 6.029528e-11 7.7588053e-10 ] [ 6.6784127e-10 7.1489074e-10 -4.6769694e-10 ] [ 6.0373227e-10 9.724010699999999e-10 4.9644978e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 8.8817842e-16 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.423018699623083e-34 } }