{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.41643e-10 0.0 0.0 ] "source-value" [ 5.41643 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.84288e-12 5.39313e-10 0.0 ] "source-value" [ 0.0584288 5.39313 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.47548e-12 2.03328e-11 5.3475e-10 ] "source-value" [ -0.0447548 0.203328 5.3475 ] } "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" [ [ 2.93868688326309e-09 -3.338927425993448e-09 5.006245343841935e-09 ] [ -2.804671538074977e-09 1.958746314941889e-09 -1.01311251373123e-09 ] [ 7.616164462993229e-10 5.897254855778363e-10 2.056188774407e-09 ] [ -2.930848234145825e-09 6.776039119227438e-10 -4.839370958337834e-09 ] [ 6.891418266397729e-10 7.572931329057562e-10 2.449784129384928e-09 ] [ -3.44551703222203e-09 3.152549424049025e-09 -4.461781988672346e-09 ] [ 2.187632946554052e-09 -2.415588393114208e-09 9.094121126029362e-10 ] [ 2.603958541468932e-09 -1.381402450289595e-09 -1.073648994953875e-10 ] ] "source-value" [ [ 1.8341841 -2.0839946 3.1246526 ] [ -1.7505383 1.2225533 -0.6323351 ] [ 0.4753636 0.3680777 1.2833721 ] [ -1.8292916 0.4229271 -3.0204978 ] [ 0.4301285 0.4726652 1.529035 ] [ -2.1505226 1.9676666 -2.7848253 ] [ 1.3654131 -1.5076917 0.5676104 ] [ 1.6252631 -0.8622036 -0.0670119 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.33581e-12 2.77146e-12 -1.24532e-11 ] [ 1.5025e-10 1.22494e-10 1.34546e-10 ] [ 4.58685e-12 2.70233e-10 2.56072e-10 ] [ 1.46199e-10 4.10879e-10 4.17844e-10 ] [ 2.74075e-10 -3.40431e-12 2.6907e-10 ] [ 4.13695e-10 1.41216e-10 4.09761e-10 ] [ 2.75898e-10 2.67415e-10 5.40851e-12 ] [ 4.02257e-10 4.13506e-10 1.27654e-10 ] ] "source-value" [ [ 0.0133581 0.0277146 -0.124532 ] [ 1.5025 1.22494 1.34546 ] [ 0.0458685 2.70233 2.56072 ] [ 1.46199 4.10879 4.17844 ] [ 2.74075 -0.0340431 2.6907 ] [ 4.13695 1.41216 4.09761 ] [ 2.75898 2.67415 0.0540851 ] [ 4.02257 4.13506 1.27654 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.296222028867951e-18 "source-value" -26.814909 } }