{ "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" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5769395 -1.8185301 -1.3377459 ] [ -4.3227872 -2.730231 3.6419205 ] [ -1.3995435 0.8784243 -1.0818878 ] [ 1.6831294 -0.3760947 -8.6283125 ] [ 1.6811976 -7.4892978 7.4402346 ] [ -2.3974388 7.8334762 -3.2843069 ] [ 5.3323821 3.7022531 3.2500979 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.24358986131643e-10 -2.913606434445683e-09 -2.143305223209301e-09 ] [ -6.925868645594284e-09 -4.374312313622453e-09 5.834999927985597e-09 ] [ -2.242315893966579e-09 1.407390888197806e-09 -1.733375353769665e-09 ] [ 2.696670596678439e-09 -6.025701405112397e-10 -1.382408067835012e-08 ] [ 2.693575511856878e-09 -1.199917794022761e-08 1.192057002759834e-08 ] [ -3.841120426804999e-09 1.255061253063511e-08 -5.262039774064974e-09 ] [ 8.543418004179851e-09 5.931663409974064e-09 5.207230913592468e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.723812 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.878361764780881e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0473356 1.2059272 1.3583105 ] [ 2.0544906 1.5833573 3.8732747 ] [ 1.4574291 3.4914031 2.3049676 ] [ 4.2972045 2.1057034 1.5964691 ] [ 4.4157803 2.0117731 4.0483746 ] [ 3.6583706 4.4322455 2.0588731 ] [ 4.7748972 4.3687075 4.1678313 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0473356e-10 1.2059272e-10 1.3583105e-10 ] [ 2.0544906e-10 1.5833573e-10 3.8732747e-10 ] [ 1.4574291e-10 3.4914031e-10 2.3049676e-10 ] [ 4.2972045e-10 2.1057034e-10 1.5964691e-10 ] [ 4.4157803e-10 2.0117731e-10 4.0483746e-10 ] [ 3.6583706e-10 4.4322455e-10 2.0588731e-10 ] [ 4.7748972e-10 4.3687075e-10 4.1678313e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.4e-06 4e-07 3e-06 ] [ -8e-07 3.3e-06 1.6e-06 ] [ -6e-07 3e-07 -3.2e-06 ] [ 3e-07 1e-06 -3.6e-06 ] [ 5e-07 -3.3e-06 -2.2e-06 ] [ -3e-06 -3.3e-06 3e-07 ] [ 1.3e-06 1.6e-06 4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.845223921599999e-15 6.408706536e-16 4.806529901999999e-15 ] [ -1.2817413072e-15 5.2871828922e-15 2.5634826144e-15 ] [ -9.613059803999998e-16 4.806529901999999e-16 -5.1269652288e-15 ] [ 4.806529901999999e-16 1.602176634e-15 -5.767835882399999e-15 ] [ 8.010883169999999e-16 -5.2871828922e-15 -3.5247885948e-15 ] [ -4.806529901999999e-15 -5.2871828922e-15 4.806529901999999e-16 ] [ 2.0828296242e-15 2.5634826144e-15 6.408706535999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.082717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.897170665663458e-18 } }