{ "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" [ 5.51396 0 0 ] "si-unit" "m" "si-value" [ 5.51396e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0181329 5.46551 0 ] "si-unit" "m" "si-value" [ 1.81329e-12 5.46551e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.147171 -0.00272143 5.46493 ] "si-unit" "m" "si-value" [ 1.47171e-11 -2.72143e-13 5.46493e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0812176 -0.117418 -0.0378641 ] [ 1.41633 1.35692 1.32004 ] [ 0.0825096 2.73802 2.72856 ] [ 1.5042 4.09281 4.08646 ] [ 2.79856 -0.0135645 2.62504 ] [ 4.22175 1.43085 4.07963 ] [ 2.7526 2.68069 -0.168753 ] [ 4.2604 4.00574 1.18537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.12176e-12 -1.17418e-11 -3.78641e-12 ] [ 1.41633e-10 1.35692e-10 1.32004e-10 ] [ 8.25096e-12 2.73802e-10 2.72856e-10 ] [ 1.5042e-10 4.09281e-10 4.08646e-10 ] [ 2.79856e-10 -1.35645e-12 2.62504e-10 ] [ 4.22175e-10 1.43085e-10 4.07963e-10 ] [ 2.7526e-10 2.68069e-10 -1.68753e-11 ] [ 4.2604e-10 4.00574e-10 1.18537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2319407 1.8103107 -0.6717458 ] [ -0.4643579 -0.3231504 -0.5223596 ] [ 0.2543183 0.2233373 -0.4175123 ] [ -0.2885629 -0.4633275 -0.6474587 ] [ 0.6640275 0.0467923 0.439813 ] [ 0.3447187 -1.6738093 -0.8854711 ] [ -0.1747888 0.9739084 1.4478199 ] [ -1.5672956 -0.5940614 1.2569146 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.973786587751987e-09 2.900437479924083e-09 -1.076255415880593e-09 ] [ -7.439833710637844e-10 -5.177440158821684e-10 -8.369123387704398e-10 ] [ 4.074628345016006e-10 3.578258006125958e-10 -6.689284459564358e-10 ] [ -4.623287320102484e-10 -7.42332488273712e-10 -1.037343192073561e-09 ] [ 1.063889336068272e-09 7.496952909345985e-11 7.046581061239104e-10 ] [ 5.52300241892569e-10 -2.681738128137614e-09 -1.418681094814059e-09 ] [ -2.80042528937687e-10 1.560373269280735e-09 2.319663194908994e-09 ] [ -2.511084368202709e-09 -9.51791286399717e-10 2.013799186462184e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.943836 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.919055032186939e-18 } }