{ "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" [ [ 2.669584 2.17361 1.86928 ] [ 2.40373 2.157546 4.053208 ] [ 2.652376 4.1548 1.079323 ] [ 1.859138 4.715654 3.12876 ] [ 4.632592 2.488435 2.820091 ] [ 5.239324 3.537857 1.028061 ] [ 3.752209 4.156911 4.495978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.669584e-10 2.17361e-10 1.86928e-10 ] [ 2.40373e-10 2.157546e-10 4.053208e-10 ] [ 2.652376e-10 4.1548e-10 1.079323e-10 ] [ 1.859138e-10 4.715654e-10 3.12876e-10 ] [ 4.632592e-10 2.488435e-10 2.820091e-10 ] [ 5.239324e-10 3.537857e-10 1.028061e-10 ] [ 3.752209000000001e-10 4.156911e-10 4.495978e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1633548 -7.4340875 -7.0357168 ] [ -0.6183615 1.0959962 3.3238961 ] [ 1.9084765 4.1212546 -3.4867995 ] [ -0.4846288 -1.0166958 1.5047725 ] [ 2.25234 -1.1058584 5.2040755 ] [ -0.7215901 1.9626085 -3.1088869 ] [ 1.8271186 2.3767823 3.5986593 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.670429779611742e-09 -1.191072128761148e-08 -1.127246106040125e-08 ] [ -9.90724346665191e-10 1.755979502592791e-09 5.325468665263727e-09 ] [ 3.057716454838101e-09 6.602977822885016e-09 -5.586468686342883e-09 ] [ -7.764609395234592e-10 -1.628926254645937e-09 2.410911338985765e-09 ] [ 3.608646519823559e-09 -1.771780488992626e-09 8.337848167671865e-09 ] [ -1.156114797545723e-09 3.144445480389789e-09 -4.980985948928694e-09 ] [ 2.927366728466792e-09 3.808025065164777e-09 5.765687844186796e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.668755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.830846641287067e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6909996 2.2932023 1.7052039 ] [ 2.5018448 2.2044736 4.1513707 ] [ 2.7945044 4.6024667 0.8581907 ] [ 1.8213975 4.3344631 3.0522979 ] [ 4.8003227 2.4149125 3.2130002 ] [ 4.8115284 3.3028061 0.9670132 ] [ 3.7883555 4.2324886 4.5276244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6909996e-10 2.2932023e-10 1.7052039e-10 ] [ 2.5018448e-10 2.2044736e-10 4.151370700000001e-10 ] [ 2.7945044e-10 4.6024667e-10 8.581907e-11 ] [ 1.8213975e-10 4.3344631e-10 3.0522979e-10 ] [ 4.8003227e-10 2.4149125e-10 3.213000200000001e-10 ] [ 4.811528400000001e-10 3.302806100000001e-10 9.670132e-11 ] [ 3.7883555e-10 4.2324886e-10 4.5276244e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.5e-05 -4.33e-05 2.01e-05 ] [ -1.78e-05 -2.83e-05 -8.8e-05 ] [ 3.78e-05 2.95e-05 -4.58e-05 ] [ 7.96e-05 -9.31e-05 8.23e-05 ] [ -7.37e-05 0.0001126 -8.5e-06 ] [ 2.19e-05 -3.34e-05 1.47e-05 ] [ 2.72e-05 5.59e-05 2.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2016324755e-13 -6.93742482522e-14 3.22037503434e-14 ] [ -2.851874408519999e-14 -4.53415987422e-14 -1.40991543792e-13 ] [ 6.056227676519999e-14 4.726421070299999e-14 -7.33796898372e-14 ] [ 1.275332600664e-13 -1.491626446254e-13 1.318591369782e-13 ] [ -1.180804179258e-13 1.804050889884e-13 -1.3618501389e-14 ] [ 3.50876682846e-14 -5.351269957559999e-14 2.35519965198e-14 ] [ 4.35792044448e-14 8.956167384059998e-14 4.037485117679999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.254434 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.565553415769516e-18 } }