{ "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" [ [ 1.3813912 -0.412815 0.4029656 ] [ -0.6415483 2.4929462 0.3435294 ] [ 0.3638487 -0.807451 -1.3544043 ] [ -0.4316915 -0.962425 -0.894081 ] [ 0.6442545 -0.6771745 -0.6065628 ] [ -1.4182061 2.2176454 -0.548293 ] [ 0.6783594 -1.0674632 0.2680411 ] [ -0.5764079 -0.7832629 2.3888051 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.213232703053221e-09 -6.614025471647099e-10 6.456220686257903e-10 ] [ -1.027873695842422e-09 3.99414015145909e-09 5.503947777720396e-10 ] [ 5.829498854512758e-10 -1.293679125299934e-09 -2.169994922449126e-09 ] [ -6.91646034396411e-10 -1.54197484697745e-09 -1.432475687103354e-09 ] [ 1.032209506249353e-09 -1.084953161040633e-09 -9.71820745213615e-10 ] [ -2.272216675616267e-09 3.553059642377583e-09 -8.784622331857619e-10 ] [ 1.086851580134259e-09 -1.710264596694868e-09 4.294491873716573e-10 ] [ -9.235072690330085e-10 -1.254925516659079e-09 3.827287714400033e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.908811292303476 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.593008177324397e-18 } }