{ "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" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0492604 0.2047314 0.1217986 ] [ -0.037143 -0.0485847 -0.0497284 ] [ -0.067951 0.1206631 -0.2621511 ] [ 0.0167752 0.2802 -0.1020117 ] [ -0.1587088 -0.1803081 -0.0614795 ] [ 0.0743776 -0.0666274 -0.0790568 ] [ -0.0345263 -0.2666672 0.1423687 ] [ 0.157916 -0.0434071 0.2902603 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.892386121125633e-11 3.280158626236532e-10 1.951428693661709e-10 ] [ -5.950964622637441e-11 -7.784127046858176e-11 -7.967367986979072e-11 ] [ -1.088695035599808e-10 1.933235978132525e-10 -4.200123635370029e-10 ] [ 2.687683324924416e-11 4.4892988914816e-10 -1.634407607880634e-10 ] [ -2.542795288752231e-10 -2.888854223608685e-10 -9.850101755847361e-11 ] [ 1.191660518312141e-10 -1.067488625846899e-10 -1.266629566752614e-10 ] [ -5.531723066272704e-11 -4.272479533741977e-10 2.280998026736889e-10 ] [ 2.530093232502528e-10 -6.954584079672768e-11 4.650482666063943e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 29.340014 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.700788448474469e-18 } }