{ "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" [ 5.42981 0 0 ] "si-unit" "m" "si-value" [ 5.42981e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0370196 5.47054 0 ] "si-unit" "m" "si-value" [ 3.70196e-12 5.47054e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0339139 -0.0143321 5.52419 ] "si-unit" "m" "si-value" [ -3.39139e-12 -1.43321e-12 5.52419e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0865271 0.0202603 -0.0485063 ] [ 1.27669 1.31148 1.22292 ] [ -0.0137625 2.6467 2.79128 ] [ 1.29807 4.01993 4.311 ] [ 2.70854 -0.0697941 2.82717 ] [ 4.06866 1.27154 4.01384 ] [ 2.71531 2.7055 0.0603487 ] [ 4.06455 4.01651 1.33765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.65271e-12 2.02603e-12 -4.850630000000001e-12 ] [ 1.27669e-10 1.31148e-10 1.22292e-10 ] [ -1.37625e-12 2.6467e-10 2.79128e-10 ] [ 1.29807e-10 4.019929999999999e-10 4.311e-10 ] [ 2.70854e-10 -6.97941e-12 2.82717e-10 ] [ 4.06866e-10 1.27154e-10 4.01384e-10 ] [ 2.71531e-10 2.7055e-10 6.03487e-12 ] [ 4.06455e-10 4.016510000000001e-10 1.33765e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7090404 -1.0392037 -0.1580269 ] [ 1.6852285 0.8416458 2.7084064 ] [ 0.2516789 0.5667345 -0.8328956 ] [ 1.0460777 -0.282092 -2.0681301 ] [ -1.0747336 -0.6931413 -1.2937536 ] [ -0.12205 0.5739066 1.7442825 ] [ 0.2589287 -0.8388912 -1.0299422 ] [ 0.6639103 0.8710412 0.9300595 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.340361229442014e-09 -1.664987886106346e-09 -2.531870067234546e-10 ] [ 2.700033725650868e-09 1.348465234864237e-09 4.339345449456057e-09 ] [ 4.032340528508225e-10 9.08008773581673e-10 -1.33444586888141e-09 ] [ 1.676001248288462e-09 -4.519612110383279e-10 -3.313509722292083e-09 ] [ -1.721913061694702e-09 -1.110534794920384e-09 -2.072821788073382e-09 ] [ -1.955456581797e-10 9.194997446183844e-10 2.794648664595104e-09 ] [ 4.148495130119958e-10 -1.344051879108221e-09 -1.650149327210555e-09 ] [ 1.06370156973193e-09 1.39556185789132e-09 1.490119599129723e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.098206 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.78357021825186e-18 } }