{ "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" [ [ 1.5622749 -0.2573931 0.671937 ] [ -0.5584281 2.0246126 0.2785439 ] [ 0.2565013 -0.6192888 -1.1676397 ] [ -0.450867 -0.680735 -0.7224197 ] [ 0.7030275 -0.6064475 -0.5860754 ] [ -1.382868 2.2274402 -0.9356449 ] [ 0.4913188 -1.076853 0.2688034 ] [ -0.6209594 -1.0113355 2.1924955 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.503040320042658e-09 -4.123892071752364e-10 1.07656175205049e-09 ] [ -8.947004462177644e-10 3.243786973897102e-09 4.462765244464532e-10 ] [ 4.10960386064807e-10 -9.92210036883287e-10 -1.870765028857926e-09 ] [ -7.223685664902336e-10 -1.090657701960288e-09 -1.15744395374535e-09 ] [ 1.126374224279472e-09 -9.71636006242608e-10 -9.389963039060083e-10 ] [ -2.215598779252454e-09 3.568752612670077e-09 -1.499068384150754e-09 ] [ 7.871794947195111e-10 -1.725308700638342e-09 4.306705230715508e-10 ] [ -9.948866331459957e-10 -1.620338093885079e-09 3.512765031309207e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.263373038775914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.765897267887582e-18 } }