{ "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" [ 5.39198 0 0 ] "si-unit" "m" "si-value" [ 5.39198e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0815956 5.53401 0 ] "si-unit" "m" "si-value" [ 8.15956e-12 5.534010000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109849 -0.0410552 5.55668 ] "si-unit" "m" "si-value" [ -1.09849e-11 -4.10552e-12 5.55668e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0600222 -0.0188866 -0.0475744 ] [ 1.35953 1.30974 1.45574 ] [ -0.0201429 2.70129 2.75612 ] [ 1.43727 3.87805 4.08993 ] [ 2.67575 -0.0837777 2.76281 ] [ 3.98871 1.3119 4.2787 ] [ 2.73779 2.77507 0.256836 ] [ 4.26747 4.05038 1.42682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.00222e-12 -1.88866e-12 -4.75744e-12 ] [ 1.35953e-10 1.30974e-10 1.45574e-10 ] [ -2.01429e-12 2.70129e-10 2.75612e-10 ] [ 1.43727e-10 3.87805e-10 4.08993e-10 ] [ 2.67575e-10 -8.37777e-12 2.76281e-10 ] [ 3.98871e-10 1.3119e-10 4.2787e-10 ] [ 2.73779e-10 2.77507e-10 2.56836e-11 ] [ 4.26747e-10 4.05038e-10 1.42682e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2741220000000002 -0.8389955000000002 -0.5253090000000001 ] [ -0.26853330000000003 -0.8826976000000002 -0.5661267000000001 ] [ -0.4516859000000001 -1.1389984000000002 1.2151248000000001 ] [ 0.4293904000000001 0.7597657000000002 0.6190774000000001 ] [ 0.09971790000000003 -0.22755980000000006 0.5994081000000001 ] [ -0.8528270000000002 0.8478983000000002 -0.5014738000000001 ] [ -0.3661187000000001 0.05488530000000001 -0.32695440000000003 ] [ 0.13593470000000002 1.4257019000000002 -0.5137463000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.041368480446938e-09 -1.344218975056407e-09 -8.416377984958274e-10 ] [ -4.302377751662727e-10 -1.414237457956271e-09 -9.070349631506555e-10 ] [ -7.236805889250069e-10 -1.824876607608607e-09 1.946844545914276e-09 ] [ 6.879592600759605e-10 1.217278841825747e-09 9.918713367456502e-10 ] [ 1.597656880552724e-10 -3.645909913939239e-10 9.603576441381487e-10 ] [ -1.366379480987002e-09 1.358482833076065e-09 -8.034495983037352e-10 ] [ -5.865868215776891e-10 8.793594448559425e-11 -5.238386957476917e-10 ] [ 2.177913982954618e-10 2.28422625241014e-09 -8.231123108825032e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 629.49622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.008564126565973e-16 } }