{ "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" [ 5.41274 0 0 ] "si-unit" "m" "si-value" [ 5.412740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00162551 5.52562 0 ] "si-unit" "m" "si-value" [ 1.62551e-13 5.52562e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0447781 -0.0207227 5.37358 ] "si-unit" "m" "si-value" [ 4.47781e-12 -2.07227e-12 5.37358e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0391133 0.018955 -0.194937 ] [ 1.34586 1.33293 1.3663 ] [ 0.0913327 2.8499 2.77756 ] [ 1.30939 4.04312 4.06983 ] [ 2.74681 -0.0301059 2.75341 ] [ 4.03842 1.37613 4.21696 ] [ 2.56627 2.70409 -0.0178064 ] [ 4.07687 4.07853 1.33472 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.91133e-12 1.8955e-12 -1.94937e-11 ] [ 1.34586e-10 1.33293e-10 1.3663e-10 ] [ 9.13327e-12 2.8499e-10 2.77756e-10 ] [ 1.30939e-10 4.04312e-10 4.06983e-10 ] [ 2.74681e-10 -3.01059e-12 2.75341e-10 ] [ 4.03842e-10 1.37613e-10 4.21696e-10 ] [ 2.56627e-10 2.70409e-10 -1.78064e-12 ] [ 4.07687e-10 4.07853e-10 1.33472e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9967275 -0.8068359 3.7686059 ] [ -0.8759819 -0.5164129 0.4824694 ] [ -1.2639136 -1.8020494 -3.0233435 ] [ 2.076408 1.8655814 0.2584852 ] [ -0.1709653 -0.0247014 -0.24803 ] [ -1.4857325 -0.3112226 -2.5133057 ] [ 1.1027997 1.1518966 1.4538528 ] [ -0.3793419 0.4437442 -0.178734 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.596933510965235e-09 -1.292693626452361e-09 6.03797231573454e-09 ] [ -1.403477731986924e-09 -8.273846818761784e-10 7.730011992999995e-10 ] [ -2.025012837314822e-09 -2.887201441993719e-09 -4.84393031225578e-09 ] [ 3.326772380250671e-09 2.988990927905007e-09 4.141389476748168e-10 ] [ -2.739166088848001e-10 -3.95760059070876e-11 -3.9738787053102e-10 ] [ -2.380405895874404e-09 -4.986335776927284e-10 -4.026759666639013e-09 ] [ 1.76687991132221e-09 1.845541817304044e-09 2.329328985435475e-09 ] [ -6.077727284771645e-10 7.109565887130228e-10 -2.863634385013559e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -33.99046 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.445872079091164e-18 } }