{ "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" [ [ 2.1354647000000004 -1.4378381000000002 0.7179683000000001 ] [ -0.8104431000000002 -0.23345670000000004 -0.6793329000000001 ] [ 0.5535726000000001 -2.2152794000000005 1.6707247000000005 ] [ 0.05273580000000001 1.6199480000000004 0.7942443000000002 ] [ 0.7312970000000001 -0.8078361000000002 0.7652183000000002 ] [ -1.4127661000000002 1.4729351000000002 -1.1146821000000002 ] [ 0.21177710000000005 -0.7563499000000002 -1.3354916000000001 ] [ -1.4616380000000002 2.3578771000000005 -0.8186491000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.42139164507182e-09 -2.303670607294956e-09 1.150312034212702e-09 ] [ -1.298472998006526e-09 -3.740388697907478e-10 -1.088411299087459e-09 ] [ 8.869210849426284e-10 -3.54926889246154e-09 2.67679607618666e-09 ] [ 8.449206653529722e-11 2.595442833895032e-09 1.272519659147687e-09 ] [ 1.171666965914298e-09 -1.294296123521688e-09 1.226014880169202e-09 ] [ -2.263500834727307e-09 2.359902200618454e-09 -1.785917614958052e-09 ] [ 3.393043212362815e-10 -1.211806136908237e-09 -2.139693436423274e-09 ] [ -2.341802250966492e-09 3.777735595463682e-09 -1.31162045946513e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.073166 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.779558367960324e-18 } }