{ "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" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0993832 -5.8847643 -0.559832 ] [ 5.6747237 1.0022174 -0.5173577 ] [ 4.3240238 -4.9899717 5.7512775 ] [ -19.3001989 16.8348721 -10.5398068 ] [ -5.420606 -3.6422249 -6.40332 ] [ 12.9225844 -6.1783045 -5.2818098 ] [ 8.5759501 -6.5373511 24.8356289 ] [ -3.677094 9.3955269 -7.2847802 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.965759342852149e-09 -9.428431858057364e-09 -8.969497493654879e-10 ] [ 9.091909716546025e-09 1.605729300468231e-09 -8.288984183599818e-10 ] [ 6.927849897219888e-09 -7.994816062061256e-09 9.214562426149933e-09 ] [ -3.09223277091325e-08 2.697243871499851e-08 -1.688663218183431e-08 ] [ -8.684768275320205e-09 -5.835487630552986e-09 -1.025924968402488e-08 ] [ 2.070426277657291e-08 -9.898735107637052e-09 -8.462392246792214e-09 ] [ 1.374018686456996e-08 -1.04739911806742e-08 3.979106431427512e-08 ] [ -5.891354087821595e-09 1.505329366329845e-08 -1.167150462026585e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -20.099208 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.220248141950587e-18 } }