{ "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" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3677615 3.3358501 1.802526 ] [ 0.1752349 -0.6705406 -0.5463639 ] [ -1.2845324 0.9902371 -0.9959707 ] [ 1.701581 -3.3818878 -1.3879983 ] [ -0.0577994 0.9809152 -2.0365498 ] [ 1.416547 -1.1611766 1.6402857 ] [ -0.0221216 0.988872 1.217617 ] [ 0.438852 -1.0822694 0.306454 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.793572150184791e-09 5.344621084746562e-09 2.887965039377484e-09 ] [ 2.807572622413266e-10 -1.07432448146834e-09 -8.753714742411125e-10 ] [ -2.058047796895942e-09 1.586534743739921e-09 -1.595720983688624e-09 ] [ 2.726233319058354e-09 -5.418381611969664e-09 -2.223818444291722e-09 ] [ -9.260484813921959e-11 1.571599413375437e-09 -3.262912503537373e-09 ] [ 2.269558504362798e-09 -1.860410016467564e-09 2.628027421624333e-09 ] [ -3.54427106266944e-11 1.584347612416848e-09 1.950837506561178e-09 ] [ 7.03118420184168e-10 -1.733986744373199e-09 4.90993438195836e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.238237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.645787994475425e-18 } }