{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0228521 4.4059586 2.8513177 ] [ -3.9214282 -1.6534137 1.441617 ] [ 0.8937542 -0.04597379999999999 -1.178092 ] [ 3.63486 -3.8386175 -0.9475104 ] [ -4.4226916 -2.0967238 -1.4102903 ] [ 3.2689875 1.7097601 2.8372015 ] [ 2.4906825 0.9146156 -2.351112 ] [ 3.0786877 0.6043945 -1.2431316 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.047496204356183e-09 7.059123861132698e-09 4.568314557413229e-09 ] [ -6.282820582185827e-09 -2.649060774650425e-09 2.309725053547834e-09 ] [ 1.431952083981808e-09 -7.365814752933502e-11 -1.887511459551514e-09 ] [ 5.823687711881088e-09 -6.150143214693744e-09 -1.518079010844856e-09 ] [ -7.085933082528547e-09 -3.359321852634935e-09 -2.259534147201018e-09 ] [ 5.23749534618744e-09 2.73933765939667e-09 4.545697911798691e-09 ] [ 3.990513271335697e-09 1.465375731338964e-09 -3.766896679282329e-09 ] [ 4.932601455684525e-09 9.683467376401056e-10 -1.991716386097697e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 148.80844 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.384174035457196e-17 } }