{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3116643 -0.1167019 -2.4030618 ] [ 1.9717197 0.7627261 1.9035023 ] [ 0.6074068 1.0614844 -1.0587747 ] [ -0.9306268 -1.0833487 0.2534177 ] [ 0.0247083 1.8951428 -0.878614 ] [ -0.6239493 -1.1843678 1.9795019 ] [ -0.2603153 -0.6832626 -1.2522968 ] [ 0.5227209 -0.6516724 1.4563254 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.101517875797997e-09 -1.869770557829395e-10 -3.850129434297566e-09 ] [ 3.15904320611079e-09 1.222021925493963e-09 3.049746882699028e-09 ] [ 9.731729742749416e-10 1.700685489023916e-09 -1.696344071034534e-09 ] [ -1.491028501649917e-09 -1.735715959314073e-09 4.060199142369082e-10 ] [ 3.958706059971264e-11 3.03635348723745e-09 -1.407694809507571e-09 ] [ -9.996769810245254e-10 -1.89756639958833e-09 3.17151166500918e-09 ] [ -4.170710876965383e-10 -1.094707363587022e-09 -2.006400655262654e-09 ] [ 8.374912051835349e-10 -1.044094283700626e-09 2.333290508157208e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.035956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.773596621137749e-18 } }