{ "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" [ [ 2.3049496000000005 -1.4358684000000002 1.0754334000000003 ] [ -0.6100827000000001 -0.19492830000000005 -0.5632360000000001 ] [ 0.7450273000000001 -1.9727637000000005 1.5485806000000004 ] [ -0.24684050000000005 1.9830930000000004 1.0335319000000003 ] [ 0.6345047000000001 -0.6615588000000001 0.7794840000000002 ] [ -1.2074535000000002 1.2739468000000003 -1.4137751000000003 ] [ 0.35808190000000006 -0.9968504000000002 -1.8861064000000005 ] [ -1.9781868000000005 2.0049299000000005 -0.5739125000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.692936361242313e-09 -2.300514781025503e-09 1.723034250707455e-09 ] [ -9.774602386945403e-10 -3.123095649922887e-10 -9.024035511929089e-10 ] [ 1.193665321917748e-09 -3.160715878502906e-09 2.481099632744437e-09 ] [ -3.954820781665825e-10 3.177265241472135e-09 1.655900647031004e-09 ] [ 1.016588596127718e-09 -1.059934042644503e-09 1.248871041087668e-09 ] [ -1.934553768403133e-09 2.041087779102974e-09 -2.265117412289182e-09 ] [ 5.737104485116436e-10 -1.597130405315129e-09 -3.021875578421254e-09 ] [ -3.169404642535166e-09 3.212251812122883e-09 -9.195091898848802e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.880978 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.748766408303915e-18 } }