{ "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" [ 5.4726 0 0 ] "si-unit" "m" "si-value" [ 5.4726e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038105 5.56078 0 ] "si-unit" "m" "si-value" [ 3.8105e-12 5.560780000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0300683 -0.0732695 5.55519 ] "si-unit" "m" "si-value" [ -3.00683e-12 -7.32695e-12 5.55519e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0119551 0.065874 -0.0174062 ] [ 1.35048 1.36142 1.35358 ] [ 0.0629681 2.82177 2.8468 ] [ 1.33242 4.00392 4.21267 ] [ 2.75302 -0.0155517 2.72 ] [ 4.0777 1.32793 4.00537 ] [ 2.56601 2.8685 0.00815077 ] [ 4.04738 3.99965 1.27482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.19551e-12 6.587400000000001e-12 -1.74062e-12 ] [ 1.35048e-10 1.36142e-10 1.35358e-10 ] [ 6.296810000000001e-12 2.82177e-10 2.8468e-10 ] [ 1.33242e-10 4.00392e-10 4.21267e-10 ] [ 2.75302e-10 -1.55517e-12 2.72e-10 ] [ 4.0777e-10 1.32793e-10 4.00537e-10 ] [ 2.56601e-10 2.8685e-10 8.15077e-13 ] [ 4.047380000000001e-10 3.99965e-10 1.27482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2316444 -1.1154834 -0.5770855 ] [ 0.1348649 0.6431563 0.9909442 ] [ -1.5187435 -1.6067599 -2.0643961 ] [ 0.0988795 3.5232189 -0.4901015 ] [ -0.7022315 -1.4130625 -0.5989908 ] [ 0.4860831 0.8153889 1.4722803 ] [ 1.2585867 -2.6987605 0.1306136 ] [ 1.4742052 1.8523022 1.1367358 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.973311879076949e-09 -1.787201439094875e-09 -9.245929039202069e-10 ] [ 2.160773915267466e-10 1.030449995869894e-09 1.587667642837823e-09 ] [ -2.433295348739379e-09 -2.574313168228176e-09 -3.307527194740727e-09 ] [ 1.58422424481603e-10 5.644818998047182e-09 -7.85229171588351e-10 ] [ -1.125098900958771e-09 -2.263975719881625e-09 -9.59689063740967e-10 ] [ 7.787909850022853e-10 1.306397043202962e-09 2.35885309535851e-09 ] [ 2.016478202603167e-09 -4.323891013862157e-09 2.092660580026224e-10 ] [ 2.361937125161297e-09 2.967715303946795e-09 1.821251537791297e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.721083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.723148452377462e-18 } }