{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44445e-10 0.0 0.0 ] "source-value" [ 5.44445 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] "source-value" [ 0.167308 5.39053 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] "source-value" [ 0.00577721 0.0671422 5.23553 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.099248713049958e-10 1.211977720040506e-10 5.715168444130414e-09 ] [ -3.389590814225737e-09 4.556700859742036e-09 -6.45427527021347e-09 ] [ -8.622445135395706e-10 3.210942994041351e-10 2.358133858839333e-09 ] [ -7.089597741113301e-09 3.195376085775996e-09 -9.46768142258185e-09 ] [ 2.108466355584745e-09 -4.305616391484011e-09 3.853653581992677e-09 ] [ 5.824294936820372e-10 1.579181701285292e-09 -3.619846025107388e-09 ] [ 3.604061220821605e-09 -8.534360829355025e-09 5.665303260290608e-09 ] [ 5.25640103031288e-09 3.066426502627528e-09 1.949543572649676e-09 ] ] "source-value" [ [ -0.1310248 0.0756457 3.5671276 ] [ -2.1156162 2.844069 -4.0284418 ] [ -0.5381707 0.2004113 1.4718314 ] [ -4.4249789 1.9943969 -5.909262 ] [ 1.3160012 -2.6873544 2.4052614 ] [ 0.3635239 0.9856477 -2.2593302 ] [ 2.2494781 -5.3267291 3.5360042 ] [ 3.2807875 1.9139129 1.2168094 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.920022606816962e-18 "source-value" -30.708366 } }