{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4582915 4.6315498 3.921419 ] [ -4.1357439 -3.5464538 3.6346694 ] [ 0.6409989 0.5443787 -2.5144611 ] [ 4.4794411 -4.0746737 -2.9275524 ] [ -4.1036216 -2.1725707 -2.7486101 ] [ 3.9563091 2.9499706 5.4331903 ] [ 1.2008699 2.7626885 -4.2850156 ] [ 2.4200381 -1.0948895 -0.5136395 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.142970410011363e-09 7.420560807630916e-09 6.282805842160915e-09 ] [ -6.626192186196213e-09 -5.682045365107319e-09 5.823382337017163e-09 ] [ 1.026993451538517e-09 8.72190826001497e-10 -4.028610788331051e-09 ] [ 7.176855804670635e-09 -6.528346939528633e-09 -4.690456011446931e-09 ] [ -6.57472658812989e-09 -3.48084198257509e-09 -4.403758841914751e-09 ] [ 6.338705944678289e-09 4.726373927367349e-09 8.704930475017337e-09 ] [ 1.924005678402434e-09 4.426314925253021e-09 -6.865351814083285e-09 ] [ 3.877328465265253e-09 -1.754206359259402e-09 -8.229411984194017e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -30.270837 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.849922733344761e-18 } }