{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1151735 -0.3119786 1.3734 ] [ -0.3455926 0.985091 -0.6515184 ] [ 0.036968 -0.313031 -1.2947272 ] [ 0.9544407 1.0342257 0.5643832 ] [ -1.3250956 -2.362702 -0.8331644 ] [ -0.0489274 1.0991394 1.155729 ] [ -0.0211861 -1.2165138 -0.5294193 ] [ 0.8645667 1.0857693 0.2153171 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.845282890357088e-10 -4.998448191099149e-10 2.20042937100672e-09 ] [ -5.537003840414862e-10 1.578289769560493e-09 -1.043847548501023e-09 ] [ 5.92292653177344e-11 -5.015309497856448e-10 -2.074381650153846e-09 ] [ 1.529182575479987e-09 1.657012237170514e-09 9.042415682122906e-10 ] [ -2.123037190644948e-09 -3.785465906317402e-09 -1.33487652296286e-09 ] [ -7.839033639652993e-11 1.76101544968014e-09 1.851681983780563e-09 ] [ -3.394387410593088e-11 -1.949069969240567e-09 -8.482232250603016e-10 ] [ 1.385188553862208e-09 1.739594188042381e-09 3.449760236784557e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -27.299788 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.37390820863964e-18 } }