{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6992262 0.7093572 -1.1205264 ] [ 0.423375 -0.9844797 2.5643782 ] [ -0.7071433 1.0283473 -1.8044759 ] [ 1.8405373 -0.1211171 -0.8405656 ] [ -0.1174743 0.8395153 0.7773352 ] [ -2.2073423 -1.1858204 1.5907857 ] [ 0.4383113 -0.59838 -3.9731398 ] [ 2.0289623 0.3125773 2.8062086 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.722460513520611e-09 1.136515530999665e-09 -1.795281215860137e-09 ] [ 6.7832153241975e-10 -1.57731037198733e-09 4.108586832778979e-09 ] [ -1.132968472149652e-09 1.647594015696988e-09 -2.89108912359612e-09 ] [ 2.948865856065448e-09 -1.940509875978414e-10 -1.34673456366419e-09 ] [ -1.882145785555062e-10 1.3450517975455e-09 1.245428294225717e-09 ] [ -3.536552256299818e-09 -1.899893737000534e-09 2.548719678241334e-09 ] [ 7.022521232781642e-10 -9.5871045425292e-10 -6.365671751175433e-09 ] [ 3.250755988326898e-09 5.008040463788082e-10 4.496041849049852e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.052781 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.776292330891915e-18 } }