{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.56756e-10 0.0 0.0 ] "source-value" [ 5.56756 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 6.033250000000001e-11 5.387920000000001e-10 0.0 ] "source-value" [ 0.603325 5.38792 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.02741e-11 -4.50618e-11 5.48706e-10 ] "source-value" [ -0.402741 -0.450618 5.48706 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.209294667006015e-08 -2.498949899042691e-08 2.246067724529064e-08 ] [ 1.826371919048799e-09 -1.969454302169343e-09 3.821671092505929e-09 ] [ -1.827860020694199e-09 3.575573238762484e-09 3.498330221044109e-10 ] [ -4.828716964462502e-09 4.445038762332e-09 -9.112057653516883e-09 ] [ -8.531674940467916e-09 9.812849547237138e-09 1.295441140423838e-08 ] [ -1.512215268717455e-08 2.569627741709079e-08 -2.832228911865672e-08 ] [ -3.423522191354026e-09 -1.401607147175647e-08 -4.415437587956748e-09 ] [ 1.981460805482658e-08 -2.554714201069686e-09 2.263191756208643e-09 ] ] "source-value" [ [ 7.547823700000002 -15.597218600000003 14.018852200000003 ] [ 1.1399317000000002 -1.2292367000000002 2.3852995000000004 ] [ -1.1408605000000003 2.2316973000000004 0.21834860000000006 ] [ -3.013848100000001 2.7743750000000005 -5.687299100000001 ] [ -5.3250527000000005 6.1246990000000014 8.085507700000003 ] [ -9.438505400000002 16.038355000000003 -17.677382600000005 ] [ -2.1367945000000006 -8.748143800000001 -2.7558994000000006 ] [ 12.367305700000003 -1.5945272000000004 1.4125732000000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.36492e-11 6.38405e-12 1.89929e-11 ] [ 1.53887e-10 1.35333e-10 1.11771e-10 ] [ 3.18438e-11 2.15889e-10 3.01891e-10 ] [ 1.68585e-10 3.81794e-10 4.45016e-10 ] [ 2.72641e-10 -3.20403e-11 2.65546e-10 ] [ 4.33601e-10 7.481900000000001e-11 4.56114e-10 ] [ 3.14234e-10 2.88247e-10 7.698180000000001e-12 ] [ 4.12798e-10 3.93896e-10 1.35009e-10 ] ] "source-value" [ [ -0.336492 0.0638405 0.189929 ] [ 1.53887 1.35333 1.11771 ] [ 0.318438 2.15889 3.01891 ] [ 1.68585 3.81794 4.45016 ] [ 2.72641 -0.320403 2.65546 ] [ 4.33601 0.74819 4.56114 ] [ 3.14234 2.88247 0.0769818 ] [ 4.12798 3.93896 1.35009 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.370480852581145e-18 "source-value" -21.036887 } }