{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.954174 1.1768695 -1.1758713 ] [ -0.1845835 0.6299375 0.0235318 ] [ 0.883779 0.6628746 -1.1830982 ] [ 0.5565706 1.0404681 -1.347625 ] [ -0.3775634 -0.9960956 0.3262239 ] [ -0.9336145 -0.5785194 1.9562752 ] [ 1.2896694 -0.8105864 0.4532722 ] [ -0.2800836 -1.1249483 0.9472914 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.528755274975219e-09 1.885552798632586e-09 -1.883953505929703e-09 ] [ -2.957353682854368e-10 1.0092711350652e-09 3.770209980534144e-11 ] [ 1.415970051754003e-09 1.062042186642152e-09 -1.895532276150563e-09 ] [ 8.917244031446286e-10 1.667013664508197e-09 -2.1591332686056e-09 ] [ -6.049232523497587e-10 -1.595921082401749e-09 5.226683057261972e-10 ] [ -1.495815324739882e-09 -9.268902573592436e-10 3.134298389290844e-09 ] [ 2.066278161241164e-09 -1.298702579218437e-09 7.262221216985818e-10 ] [ -4.487433957894989e-10 -1.802365865868705e-09 1.517728134164901e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 673.86574 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.079651934186091e-16 } }