{ "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" [ [ 2.0274209 -0.6952763 0.5992203 ] [ -0.8263587 3.0187595 0.2053944 ] [ 0.3873469 -0.7331704 -1.4453109 ] [ -0.5590755 -0.9656584 -1.1293023 ] [ 0.9786437 -0.9804526 -0.5543691 ] [ -1.9371418 2.9225997 -0.9384692 ] [ 0.765006 -1.567787 0.3114108 ] [ -0.8358414 -0.9990144 2.9514262 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.248286366501295e-09 -1.113955432856327e-09 9.600567553687623e-10 ] [ -1.323972589534681e-09 4.836585894717898e-09 3.290781057232436e-10 ] [ 6.205981473193555e-10 -1.174668473942584e-09 -2.315643333767407e-09 ] [ -8.957376953620703e-10 -1.547155312159135e-09 -1.809341742875668e-09 ] [ 1.567960056233209e-09 -1.570858233522574e-09 -8.881972113139372e-10 ] [ -3.10364330313443e-09 4.682520911297094e-09 -1.50359341158088e-09 ] [ 1.225674727971725e-09 -2.51187167779417e-09 4.989351032246246e-10 ] [ -1.339165549776741e-09 -1.60059751552254e-09 4.728706055656586e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.023934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.771670484404223e-18 } }