{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7655839 2.475119 1.769415 ] [ 1.428497 2.830976 4.007072 ] [ 0.7084804 4.393179 2.503204 ] [ 3.286235 1.82381 2.638008 ] [ 3.156295 4.152222 2.34568 ] [ 4.226983 3.319682 4.150219 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.655839e-11 2.475119e-10 1.769415e-10 ] [ 1.428497e-10 2.830976e-10 4.007072e-10 ] [ 7.084804e-11 4.393179e-10 2.503204e-10 ] [ 3.286235e-10 1.82381e-10 2.638008e-10 ] [ 3.156295e-10 4.152222e-10 2.34568e-10 ] [ 4.226983e-10 3.319682e-10 4.150219e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.368996 -9.2132556 -8.216819 ] [ -4.5824791 -4.3182494 12.5654146 ] [ -3.3262379 10.1534997 -0.4590678 ] [ 2.1898912 -8.6029726 -3.1299658 ] [ 5.8999026 10.7445747 -6.6512222 ] [ 5.1879191 1.2364032 5.8916602 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.602079868368716e-09 -1.476126272377468e-08 -1.316479529914523e-08 ] [ -7.341940879324625e-09 -6.918598231463628e-09 2.013201350277899e-08 ] [ -5.329220598598889e-09 1.626769983863981e-08 -7.355076965220902e-10 ] [ 3.508592482735657e-09 -1.378348156910299e-08 -5.014758028663569e-09 ] [ 9.452686010717134e-09 1.721470638477917e-08 -1.065643270858594e-08 ] [ 8.311962692621777e-09 1.980936300922306e-09 9.439480230137851e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5047606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.042177535722098e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9742804 2.04955 1.5657764 ] [ 1.4468964 3.5268744 4.8760407 ] [ 0.9119791 4.1726846 2.6456735 ] [ 3.325856 1.8660173 1.9272097 ] [ 3.2586539 4.4868408 2.1704246 ] [ 3.6544086 2.8930208 4.2284731 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.742804000000001e-11 2.04955e-10 1.5657764e-10 ] [ 1.4468964e-10 3.5268744e-10 4.8760407e-10 ] [ 9.119791e-11 4.1726846e-10 2.6456735e-10 ] [ 3.325856e-10 1.8660173e-10 1.9272097e-10 ] [ 3.2586539e-10 4.486840800000001e-10 2.1704246e-10 ] [ 3.6544086e-10 2.8930208e-10 4.228473100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.25e-05 2.22e-05 -1.9e-06 ] [ 3.55e-05 4.6e-06 -9.3e-06 ] [ -5.55e-05 5.8e-06 -1.14e-05 ] [ -8e-06 -3.11e-05 -3.9e-06 ] [ -6.6e-06 6.9e-06 4.3e-06 ] [ 2.1e-06 -8.5e-06 2.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.207074017599999e-14 3.556832098176e-14 -3.04413557952e-15 ] [ 5.68772700384e-14 7.370012455680001e-15 -1.490024257344e-14 ] [ -8.892080245440001e-14 9.292624400640001e-15 -1.826481347712e-14 ] [ -1.28174129664e-14 -4.982769290688e-14 -6.24848882112e-15 ] [ -1.057436569728e-14 1.105501868352e-14 6.889359469440001e-15 ] [ 3.36457090368e-15 -1.36185012768e-14 3.556832098176e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.124626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423232217554382e-18 } }