{ "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" [ [ 0.0201338 -0.4162305 1.4236307 ] [ -0.4418654 0.7260813 -0.7840729 ] [ -0.0073949 -0.2965602 -1.4206747 ] [ 1.1454297 1.059166 0.3865156 ] [ -1.2562542 -2.3719168 -0.9451944 ] [ 0.0064872 1.2717922 1.5690722 ] [ -0.2812329 -1.0871968 -0.4402878 ] [ 0.8146969 1.1148649 0.2110114 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.22579039136292e-11 -6.668747814581369e-10 2.280907842985063e-09 ] [ -7.079464192530636e-10 1.163310493244344e-09 -1.256223279732618e-09 ] [ -1.18479359907666e-11 -4.751418230143667e-10 -2.27617180885496e-09 ] [ 1.83518070122963e-09 1.696971016727244e-09 6.192662629964904e-10 ] [ -2.012741125604363e-09 -3.800229674752051e-09 -1.514368382267649e-09 ] [ 1.03936402600848e-11 2.037635746143454e-09 2.513930815898975e-09 ] [ -4.505847810920586e-10 -1.741881309519571e-09 -7.054188253952651e-10 ] [ 1.305288336972234e-09 1.786210492846746e-09 3.380775345876275e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.20110607419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.197879993702294e-18 } }