{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] "source-value" [ 5.41852 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] "source-value" [ 0.038783 5.47951 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] "source-value" [ 0.00323821 0.0198894 5.39896 ] } "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" [ [ -1.332807472074758e-10 -4.536372442777325e-10 2.131279428052992e-09 ] [ -6.606830041951508e-10 1.338651731734451e-09 -1.048266351621189e-09 ] [ 4.253089992277056e-11 -4.465003485203788e-10 -1.98814176983903e-09 ] [ 1.603089060385545e-09 1.58974741522882e-09 6.053518345958227e-10 ] [ -1.964694716081933e-09 -3.62712375218971e-09 -1.175420215213064e-09 ] [ -1.112335151639712e-10 1.784682161851949e-09 1.945890289518928e-09 ] [ -8.640073884754369e-11 -1.857594816599626e-09 -8.484159669077837e-10 ] [ 1.31067292140542e-09 1.671774852772228e-09 3.777227514133248e-10 ] ] "source-value" [ [ -0.0831873 -0.2831381 1.33024 ] [ -0.4123659 0.8355207 -0.6542764 ] [ 0.0265457 -0.2786836 -1.2409005 ] [ 1.0005695 0.9922423 0.3778309 ] [ -1.226266 -2.2638726 -0.7336396 ] [ -0.0694265 1.113911 1.2145292 ] [ -0.0539271 -1.1594195 -0.5295396 ] [ 0.8180577 1.0434398 0.235756 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.170585266318312e-18 "source-value" -26.030746 } }