{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.313891 1.116241 2.673861 ] [ 0.9757071 2.889413 1.489712 ] [ 1.633474 0.1638512 0.5892112 ] [ 2.566803 2.188641 0.090681 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.313891e-10 1.116241e-10 2.673861e-10 ] [ 9.757071000000001e-11 2.889413e-10 1.489712e-10 ] [ 1.633474e-10 1.638512e-11 5.892112e-11 ] [ 2.566803e-10 2.188641e-10 9.0681e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1090769 -2.0664947 1.5093244 ] [ -1.4049556 4.8277553 0.3735078 ] [ 0.7278317 -2.9475135 -0.643762 ] [ 0.7862008 0.186253 -1.2390702 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.747604604891546e-10 -3.310889522624839e-09 2.418204286806069e-09 ] [ -2.25098703412745e-09 7.73491673632966e-09 5.984254697767451e-10 ] [ 1.166114943224498e-09 -4.722437258099559e-09 -1.031420434257108e-09 ] [ 1.259632551392107e-09 2.98410204612402e-10 -1.985209322325707e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8185071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.57309826563831e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9553898 0.9930122 2.598977 ] [ 1.2590706 3.0761935 1.675103 ] [ 1.985853 0.1028786 0.7466224 ] [ 2.2895617 2.1860619 -0.1772372 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.553897999999999e-11 9.930122e-11 2.598977e-10 ] [ 1.2590706e-10 3.0761935e-10 1.675103e-10 ] [ 1.985853e-10 1.028786e-11 7.466224e-11 ] [ 2.2895617e-10 2.1860619e-10 -1.772372e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.31e-05 -4.3e-06 1.3e-06 ] [ 1.16e-05 -2.4e-06 2.6e-06 ] [ 8.7e-06 1.4e-06 7.6e-06 ] [ -7.2e-06 5.4e-06 -1.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.09885139054e-14 -6.8893595262e-15 2.0828296242e-15 ] [ 1.85852489544e-14 -3.845223921599999e-15 4.165659248399999e-15 ] [ 1.39389367158e-14 2.2430472876e-15 1.21765424184e-14 ] [ -1.15356717648e-14 8.6517538236e-15 -1.8425031291e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.595935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.697655947238279e-18 } }