{ "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" [ [ -0.0037769 1.9029325 -0.6185214 ] [ -0.8400647 0.7936292 -0.316308 ] [ 1.6175804 1.7628407 -1.691231 ] [ -0.4276199 0.9773732 -2.6429175 ] [ 0.2288241 -1.1071772 1.3914005 ] [ -1.5903444 -1.5642981 2.2889917 ] [ 2.4733145 -1.3524025 1.1703566 ] [ -1.4579131 -1.4128978 0.4182292 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.05126087909952e-12 3.048833962460496e-09 -9.909805265444852e-10 ] [ -1.345932022299366e-09 1.271534149824207e-09 -5.067812825720064e-10 ] [ 2.591649499144312e-09 2.824382155734707e-09 -2.709650768572205e-09 ] [ -6.851226063688339e-10 1.565924490836483e-09 -4.234420629203184e-09 ] [ 3.666166232956013e-10 -1.773893424922806e-09 2.229269351269431e-09 ] [ -2.548012616700204e-09 -2.50628184378186e-09 3.667368986945247e-09 ] [ 3.962686667785641e-09 -2.166787667411472e-09 1.875117982518978e-09 ] [ -2.335834283978053e-09 -2.263711822739754e-09 6.700770463758874e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.82924224065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.696341846375603e-18 } }