{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42631e-10 0.0 0.0 ] "source-value" [ 5.42631 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] "source-value" [ -0.0419811 5.40206 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] "source-value" [ -0.291495 -0.184222 5.7849 ] } "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" [ [ -4.279072971189556e-09 -2.541503293525217e-09 -5.948391526984435e-09 ] [ -1.413885619970342e-10 1.241318380497216e-09 9.182803364384927e-09 ] [ 6.078815112624038e-10 -6.35941872381433e-09 -8.251302523364005e-09 ] [ -8.361074052361498e-10 -3.846763581652589e-10 1.326320050654178e-08 ] [ 2.499338490960299e-09 -1.158667856465979e-09 -9.763575085917421e-09 ] [ 3.599925041657348e-09 7.001910774874579e-10 6.206049085046953e-09 ] [ -2.195871178520544e-10 3.500683017411754e-09 -4.960537327680116e-09 ] [ -1.230988827387594e-09 5.002073596356695e-09 2.717533477546541e-10 ] ] "source-value" [ [ -2.6707873 -1.5862816 -3.712694 ] [ -0.0882478 0.77477 5.7314551 ] [ 0.3794098 -3.969237 -5.150058 ] [ -0.5218572 -0.2400961 8.2782387 ] [ 1.5599644 -0.7231836 -6.0939443 ] [ 2.2468965 0.4370249 3.8735112 ] [ -0.1370555 2.1849545 -3.0961239 ] [ -0.7683228 3.1220488 0.1696151 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.231029782602923e-18 "source-value" -26.408011 } }