{ "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" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0754306 -0.4728973 1.7831221 ] [ -0.4255174 1.4064755 -0.8719512 ] [ 0.0289681 -0.43886 -1.8932977 ] [ 1.223822 1.3342993 1.0555558 ] [ -1.8732743 -3.2980294 -1.5631503 ] [ 0.169378 1.58327 1.7260596 ] [ -0.1930182 -1.5824678 -0.6255109 ] [ 1.1450722 1.4682097 0.3891727 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.208531438129165e-10 -7.576649980994439e-10 2.856876540651799e-09 ] [ -6.81754030023602e-10 2.253422163827991e-09 -1.397019827118505e-09 ] [ 4.641201256899648e-11 -7.03131231804288e-10 -3.033397311154412e-09 ] [ 1.960778996420698e-09 2.137783143609806e-09 1.691186824709841e-09 ] [ -3.001316287805486e-09 -5.284025599391051e-09 -2.504442865456506e-09 ] [ 2.713734716778624e-10 2.536678178414016e-09 2.7654523372274e-09 ] [ -3.092492474288986e-10 -2.53539291232881e-09 -1.002178940035567e-09 ] [ 1.834607907968022e-09 2.352331255771782e-09 6.235234013936122e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -37.114499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.946398259050499e-18 } }