{ "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" [ [ 1.3884367 0.2669756 1.6765637 ] [ -0.7903563 3.3394756 1.237853 ] [ 0.5070149 0.0239284 -1.6755041 ] [ -0.1087571 -0.6691409 -1.057155 ] [ 1.5017912 -1.4159332 -0.9360205 ] [ -1.3958673 3.8191548 -2.2761152 ] [ -0.1829718 -2.7589825 0.4705313 ] [ -0.9192903 -2.6054779 2.5598468 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.224520838528067e-09 4.277420681681303e-10 2.686151185552585e-09 ] [ -1.266290396394694e-09 5.350429776133131e-09 1.983259152926802e-09 ] [ 8.123274258698465e-10 3.833752336900559e-11 -2.684453519191199e-09 ] [ -1.742480844016014e-10 -1.072081914833731e-09 -1.69374903951627e-09 ] [ 2.40613476978682e-09 -2.268575088344849e-09 -1.499670174044997e-09 ] [ -2.236425972224668e-09 6.118960582188943e-09 -3.646738589732237e-09 ] [ -2.931531426409211e-10 -4.420377295114905e-09 7.538742544256441e-10 ] [ -1.47286543852285e-09 -4.174435811783388e-09 4.101326729579671e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -330.56236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.296192892718962e-17 } }