{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43103e-10 0.0 0.0 ] "source-value" [ 5.43103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] "source-value" [ 0.00138287 5.43667 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] "source-value" [ -0.0279747 -0.147199 5.47761 ] } "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" [ [ 3.509821191986148e-09 1.011453780275716e-09 -1.182594105228592e-08 ] [ 1.497099309083791e-09 1.05721162413044e-08 -2.365243357376471e-09 ] [ 3.209499112470685e-09 -9.011447210219462e-10 1.021304282575718e-09 ] [ 2.182842758893184e-09 6.221807773853817e-10 2.623697838090175e-09 ] [ 4.876122807189379e-09 -3.944096131801513e-09 8.714924852777888e-09 ] [ 1.414609002714634e-09 -8.929235041711676e-09 -5.701213325545584e-09 ] [ -1.115095445609091e-08 2.84982311829639e-09 2.177389750764292e-09 ] [ -5.539039726246911e-09 -1.281098182944411e-09 5.355081171217559e-09 ] ] "source-value" [ [ 2.1906581 0.6312998 -7.3811719 ] [ 0.9344159 6.598596 -1.4762688 ] [ 2.0032118 -0.5624503 0.637448 ] [ 1.3624233 0.3883347 1.6375834 ] [ 3.0434365 -2.4617112 5.4394283 ] [ 0.8829295 -5.5731902 -3.5584175 ] [ -6.9598784 1.7787197 1.3590198 ] [ -3.4571967 -0.7995986 3.3423788 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.51298416873349e-18 "source-value" -34.409341 } }