{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45804e-10 0.0 0.0 ] "source-value" [ 5.45804 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] "source-value" [ -0.0357167 5.39587 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] "source-value" [ 0.019829 -0.0610013 5.23355 ] } "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" [ [ -9.043695821242925e-10 8.743516816099699e-10 1.185755055505534e-09 ] [ -1.309833541073783e-09 -1.332731368685271e-09 1.086189712017863e-09 ] [ -2.29117184827897e-10 -1.927164369610341e-09 -1.032535220252202e-09 ] [ 1.054381058694472e-09 -5.932424234781542e-10 1.539228703545389e-10 ] [ -2.03412343776768e-11 1.009452982111661e-09 -4.719028588431628e-10 ] [ 6.945139248493152e-10 5.817653914727157e-10 -3.625384429250169e-10 ] [ 9.601863714573848e-10 6.761199759365587e-10 -2.695532388189715e-10 ] [ -2.454198125975232e-10 7.114479704251988e-10 -2.893378770385824e-10 ] ] "source-value" [ [ -0.5644631 0.5457274 0.7400901 ] [ -0.8175338 -0.8318255 0.6779463 ] [ -0.1430037 -1.2028414 -0.6444578 ] [ 0.6580929 -0.3702728 0.0960711 ] [ -0.012696 0.630051 -0.2945386 ] [ 0.4334815 0.3631094 -0.2262787 ] [ 0.5993012 0.4220009 -0.1682419 ] [ -0.153179 0.4440509 -0.1805905 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.720550000000001e-12 -4.52445e-11 -7.13075e-12 ] [ 1.44372e-10 1.30265e-10 8.526040000000001e-11 ] [ 8.44836e-12 2.96191e-10 2.59679e-10 ] [ 1.14061e-10 3.90928e-10 3.87091e-10 ] [ 2.7873e-10 -3.19613e-11 3.1468e-10 ] [ 4.071170000000001e-10 1.23968e-10 4.05459e-10 ] [ 2.72619e-10 2.52806e-10 3.79157e-11 ] [ 3.92833e-10 3.98172e-10 1.55502e-10 ] ] "source-value" [ [ 0.0872055 -0.452445 -0.0713075 ] [ 1.44372 1.30265 0.852604 ] [ 0.0844836 2.96191 2.59679 ] [ 1.14061 3.90928 3.87091 ] [ 2.7873 -0.319613 3.1468 ] [ 4.07117 1.23968 4.05459 ] [ 2.72619 2.52806 0.379157 ] [ 3.92833 3.98172 1.55502 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.312508614702648e-18 "source-value" 33.158071 } }