{ "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" [ [ -0.0506168 -0.2065166 1.642139 ] [ -0.4532516 1.013392 -0.7888827 ] [ 0.0568486 -0.1597486 -1.5792043 ] [ 1.0559082 1.067868 0.8716526 ] [ -1.6437825 -2.7327186 -1.33612 ] [ 0.0317167 1.0904919 1.4034699 ] [ 0.0331226 -1.1314417 -0.3370222 ] [ 0.9700549 1.0586736 0.1239677 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.109705357970944e-11 -3.308760683271053e-10 2.630996713903891e-09 ] [ -7.261891168601933e-10 1.623632970105754e-09 -1.26392941849358e-09 ] [ 9.108149784521088e-11 -2.559454721255309e-10 -2.53016420892683e-09 ] [ 1.69175143175101e-09 1.710913143700454e-09 1.396541417179534e-09 ] [ -2.633629891180176e-09 -4.378297852145306e-09 -2.140700226583296e-09 ] [ 5.081575522892736e-11 1.747160627351772e-09 2.248606661776514e-09 ] [ 5.306825534011009e-11 -1.812769439538208e-09 -5.399690895305818e-10 ] [ 1.554199281672482e-09 1.696182090978171e-09 1.986181506743482e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.113015 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.785942833959971e-18 } }