{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6246116 -0.5322925 -2.9746918 ] [ 2.4817441 1.2364422 2.4598697 ] [ 0.7421079 1.0959864 -1.5340297 ] [ -1.2361938 -1.3121702 0.4161874 ] [ 0.2860193 2.3417348 -1.0740232 ] [ -0.9157391 -1.3837062 2.458522 ] [ -0.3372868 -0.8071327 -1.6530484 ] [ 0.60396 -0.6388618 1.9012141 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.602914723400482e-09 -8.52826598927184e-10 -4.76598165604547e-09 ] [ 3.976192375828337e-09 1.980998785810517e-09 3.94114572355431e-09 ] [ 1.188987927490984e-09 1.755963786794757e-09 -2.457786520952838e-09 ] [ -1.980600805137911e-09 -2.10232841695046e-09 6.668057221515379e-10 ] [ 4.582534355575814e-10 3.751872748673763e-09 -1.720774861236803e-09 ] [ -1.467175776772433e-09 -2.216941723696009e-09 3.938986470122458e-09 ] [ -5.403930254644454e-10 -1.29316914182318e-09 -2.648475499530847e-09 ] [ 9.676505918983681e-10 -1.023569439882206e-09 3.046080782155313e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.033659 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.773228601167951e-18 } }