{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4696194 4.7280249 -0.7139302 ] [ -2.0149811 2.2209043 -7.2192564 ] [ -2.2979543 1.8054339 3.1455514 ] [ -0.4879573 1.4493393 -4.1200367 ] [ 5.7370291 -6.2882187 5.3435525 ] [ 1.8187249 -2.2729296 -1.9900871 ] [ -0.3036808 -1.3491408 3.095794 ] [ -2.9207999 -0.2934132 2.4584125 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.524132295530996e-10 7.575131019750187e-09 -1.143842284746947e-09 ] [ -3.228355636371617e-09 3.558280975810126e-09 -1.156652391893496e-08 ] [ -3.681728685459825e-09 2.892624008811492e-09 5.039728954125987e-09 ] [ -7.817937844497281e-10 2.322097561197916e-09 -6.601026531962467e-09 ] [ 9.191733972598049e-09 -1.007483707062185e-08 8.561314958052286e-09 ] [ 2.913918538453986e-09 -3.641634695846966e-09 -3.188471051244821e-09 ] [ -4.865502819544271e-10 -2.161561865736067e-09 4.960008810477396e-09 ] [ -4.679637352369536e-09 -4.700997731471688e-10 3.938811064233525e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.58310007419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.457993862815114e-18 } }