{ "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" [ [ -0.1134403 -0.4746711 1.8625312 ] [ -0.4893829 1.3371169 -0.9123893 ] [ 0.0187524 -0.4661732 -1.8684345 ] [ 1.395479 1.4671698 0.7959972 ] [ -1.9300444 -3.3662686 -1.3565533 ] [ 0.0863721 1.6615768 1.8150081 ] [ -0.1387618 -1.6622256 -0.6914612 ] [ 1.1710258 1.503475 0.3553017 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.817513980139502e-10 -7.605069452550773e-10 2.984103968735981e-09 ] [ -7.840778474591585e-10 2.142297454106515e-09 -1.461808817571616e-09 ] [ 3.00446571114216e-11 -7.468918084370087e-10 -2.993562098059473e-09 ] [ 2.235803847037686e-09 2.350665171670453e-09 1.275328114569425e-09 ] [ -3.092272040262549e-09 -5.393356894687892e-09 -2.173438000035592e-09 ] [ 1.383833604495114e-10 2.662139524556491e-09 2.907963568340735e-09 ] [ -2.223209136517812e-10 -2.66317901675663e-09 -1.107842977957601e-09 ] [ 1.876190174571157e-09 2.40883251480315e-09 5.692560817604777e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.183939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.797306159188133e-18 } }