{ "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" [ 5.42356 0 0 ] "si-unit" "m" "si-value" [ 5.42356e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0141122 5.36968 0 ] "si-unit" "m" "si-value" [ 1.41122e-12 5.36968e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.125956 0.0899535 5.38067 ] "si-unit" "m" "si-value" [ -1.25956e-11 8.99535e-12 5.380670000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0132742 0.0797855 -0.0480858 ] [ 1.38077 1.28242 1.3281 ] [ 0.0139699 2.87381 2.72647 ] [ 1.34708 4.2887 4.09361 ] [ 2.73598 0.0766444 2.67003 ] [ 4.1072 1.37855 3.98819 ] [ 2.71459 2.70679 -0.0921964 ] [ 4.08895 4.12737 1.11939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.32742e-12 7.97855e-12 -4.80858e-12 ] [ 1.38077e-10 1.28242e-10 1.3281e-10 ] [ 1.39699e-12 2.873810000000001e-10 2.72647e-10 ] [ 1.34708e-10 4.2887e-10 4.09361e-10 ] [ 2.73598e-10 7.66444e-12 2.67003e-10 ] [ 4.1072e-10 1.37855e-10 3.98819e-10 ] [ 2.71459e-10 2.70679e-10 -9.21964e-12 ] [ 4.08895e-10 4.12737e-10 1.11939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2548229 -0.9333413 0.6635104 ] [ -0.6410378 2.8678005 0.0107206 ] [ 0.1848547 -0.6473426 -1.1598643 ] [ -0.4560587 -1.0390535 -1.2743536 ] [ 0.8691382 -0.8725315 -0.3510163 ] [ -2.0594073 3.0942247 -1.2015905 ] [ 0.7703288 -1.4657243 0.4327954 ] [ -0.9226409 -1.004032 2.8797983 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.612624534424457e-09 -1.495377610087079e-09 1.063060850537656e-09 ] [ -1.027055776209066e-09 4.594722914218551e-09 1.717629468094848e-11 ] [ 2.961698785849978e-10 -1.037157179367886e-09 -1.858307464760557e-09 ] [ -7.30686586852441e-10 -1.664747225460413e-09 -2.041739544552315e-09 ] [ 1.392512904284194e-09 -1.397949570211555e-09 -5.623901093797191e-10 ] [ -3.299534228764852e-09 4.957494473841894e-09 -1.925160206875383e-09 ] [ 1.234202793688919e-09 -2.348349205998445e-09 6.934146714697843e-10 ] [ -1.478233679373871e-09 -1.608636596935066e-09 4.613945508879585e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.878184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.748318760156063e-18 } }