{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8306762 1.8115599 -6.4115289 ] [ -5.6893974 5.0068464 4.4452159 ] [ -6.0822233 -5.6340135 2.3383252 ] [ 2.4023361 -7.2923186 -3.0701119 ] [ 5.0680694 1.1336653 -4.878248 ] [ 5.2175027 -2.3666506 6.6896017 ] [ 3.9143887 7.340911 0.8867462 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.739596470294985e-09 2.902438918958786e-09 -1.027240170716354e-08 ] [ -9.115419500720305e-09 8.021852246016645e-09 7.122020989388431e-09 ] [ -9.744795973745024e-09 -9.02668471097158e-09 3.746409967267484e-09 ] [ 3.848966734723851e-09 -1.168358237234499e-08 -4.918861509419867e-09 ] [ 8.119942305271882e-09 1.816332039472218e-09 -7.815814896064358e-09 ] [ 8.359360844900877e-09 -3.791792260922292e-09 1.071792344620394e-08 ] [ 6.271542059863706e-09 1.176143597957355e-08 1.420724030223241e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 51.342739 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.226013607363637e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5216704 2.9399981 -0.4563326 ] [ -0.6605782 5.1189761 6.76574 ] [ -0.9803797 -2.0860594 5.3488109 ] [ 4.9686518 -3.2831632 1.2017079 ] [ 7.9883286 2.8535543 -1.4898993 ] [ 6.0799815 0.4523244 7.5509824 ] [ 5.9373316 7.0631792 4.1753427 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.216704e-11 2.9399981e-10 -4.563326e-11 ] [ -6.605782e-11 5.118976100000001e-10 6.76574e-10 ] [ -9.803797e-11 -2.0860594e-10 5.3488109e-10 ] [ 4.9686518e-10 -3.2831632e-10 1.2017079e-10 ] [ 7.9883286e-10 2.8535543e-10 -1.4898993e-10 ] [ 6.0799815e-10 4.523244e-11 7.5509824e-10 ] [ 5.937331600000001e-10 7.0631792e-10 4.1753427e-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" 3.9968029e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.403584164325641e-34 } }