{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] "source-value" [ 5.4207 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] "source-value" [ -0.121917 5.37017 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] "source-value" [ -0.0328689 -0.300504 5.4102 ] } "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" [ [ 3.390272540377887e-09 2.065177433859141e-08 -9.51320871322084e-09 ] [ -2.089375459841941e-09 -2.001151668304653e-08 2.127611404897333e-09 ] [ -6.781207741006139e-09 1.070748462464878e-08 4.610468785612449e-09 ] [ -5.617348191418118e-10 -4.839979625236077e-09 5.45799570471335e-10 ] [ -5.811531837641416e-09 -4.243211612103852e-09 -8.501976834407105e-09 ] [ 3.41439859658688e-11 3.540467466171149e-09 1.997304970412242e-08 ] [ 2.820944573642416e-08 1.469562106696751e-08 -1.701973815266467e-08 ] [ -1.639001224491896e-08 -2.050063957599239e-08 7.77799439540674e-09 ] ] "source-value" [ [ 2.1160416999999994 12.889823799999998 -5.937677899999999 ] [ -1.3040855999999998 -12.490206399999998 1.3279505999999999 ] [ -4.2324969999999995 6.683086299999999 2.8776282999999996 ] [ -0.35060729999999996 -3.0208776999999998 0.34066129999999994 ] [ -3.6272728999999995 -2.6484043999999995 -5.306516599999999 ] [ 0.021310999999999997 2.2097859999999994 12.466197199999998 ] [ 17.606951299999995 9.172285299999999 -10.622885099999998 ] [ -10.229841099999998 -12.795492899999998 4.854642299999999 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.062310490719972e-18 "source-value" -25.354948 } }