{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9021761 0.4050189 -0.5208133 ] [ -11.5387943 -6.4882252 4.5472782 ] [ 1.5230457 -1.3828482 -2.7940831 ] [ 0.2897125 3.4753216 3.0414409 ] [ 1.2285923 -3.0777961 4.709129 ] [ -0.5900205 -2.2557277 2.4706993 ] [ 4.80743 5.1707415 -11.1194318 ] [ 2.3778582 4.1535152 -0.3342192 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.047622076064523e-09 6.489118125621332e-10 -8.344348930616968e-10 ] [ -1.84871864596803e-08 -1.03952827259254e-08 7.285542820313507e-09 ] [ 2.440188212949971e-09 -2.215567056155362e-09 -4.476614619392389e-09 ] [ 4.6417059425352e-10 5.56807901728125e-09 4.872925503524911e-09 ] [ 1.9684218595549e-09 -4.931172955009419e-09 7.544856388131283e-09 ] [ -9.453170508927263e-10 -3.614074183830956e-09 3.958496655486926e-09 ] [ 7.702351952132545e-09 8.284441143500323e-09 -1.781529366654006e-08 ] [ 3.80974881561757e-09 6.654664947577437e-09 -5.354781884624794e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -27.773812 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.449855225689449e-18 } }