{ "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" [ [ -1.6469959 0.4087099 -3.0507997 ] [ 2.463958 0.2741089 2.4541112 ] [ 0.4681661 1.1086211 -1.336028 ] [ -1.1846504 -1.3004456 0.1455328 ] [ -0.3337559 2.6586072 -1.3263548 ] [ -0.3431368 -1.4682655 2.8482041 ] [ -0.1582411 -0.8481334 -1.8136762 ] [ 0.7346559 -0.8332025 2.0790105 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.638778347273801e-09 6.548254518644766e-10 -4.887919994354208e-09 ] [ 3.947695934757371e-09 4.391708747514425e-10 3.9319196218777e-09 ] [ 7.500847862509073e-10 1.776206822379377e-09 -2.140552843969752e-09 ] [ -1.898019190338753e-09 -2.08354355410811e-09 2.331692516405952e-10 ] [ -5.347359044396405e-10 4.259558334824164e-09 -2.125054668953743e-09 ] [ -5.497657632255311e-10 -2.352420676608327e-09 4.563326057882999e-09 ] [ -2.535301929584573e-10 -1.358859515994975e-09 -2.905829629281911e-09 ] [ 1.177048517010241e-09 -1.334937576890385e-09 3.330942044940656e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.138359 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.79000343809036e-18 } }