{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.33088e-10 0.0 0.0 ] "source-value" [ 5.33088 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] "source-value" [ 0.0480326 5.46857 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] "source-value" [ -0.109209 0.182969 5.33745 ] } "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" [ [ 6.606417641689314e-09 -4.00032612248511e-09 4.89248199179372e-09 ] [ -1.189996177238454e-09 -4.391417115187066e-10 7.845568918089236e-10 ] [ 3.62170711347011e-09 -6.81971333238681e-09 3.353014243496508e-09 ] [ 9.634844520313019e-10 1.277466368980382e-09 2.141330042212932e-09 ] [ 1.242915910805816e-09 5.168798018129088e-10 -1.466398240458359e-09 ] [ -3.102073810916694e-09 3.365834219945501e-09 -7.937298015724574e-09 ] [ -2.387375985433864e-09 4.20911665274258e-10 1.272948070692063e-09 ] [ -5.755079144407528e-09 5.678088950159915e-09 -3.040634983821214e-09 ] ] "source-value" [ [ 4.1234016 -2.4968072 3.0536471 ] [ -0.7427372 -0.2740907 0.4896819 ] [ 2.2604918 -4.2565303 2.0927869 ] [ 0.6013597 0.7973318 1.3365131 ] [ 0.7757671 0.322611 -0.9152538 ] [ -1.9361622 2.1007885 -4.9540718 ] [ -1.4900829 0.2627124 0.7945117 ] [ -3.5920379 3.5439844 -1.8978151 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.541091794062832e-18 "source-value" -34.584775 } }