{ "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" [ 5.5048 0 0 ] "si-unit" "m" "si-value" [ 5.5048e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0192448 5.36034 0 ] "si-unit" "m" "si-value" [ 1.92448e-12 5.36034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.190348 0.0157222 5.58687 ] "si-unit" "m" "si-value" [ 1.90348e-11 1.57222e-12 5.58687e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0113409 -0.0687251 -0.0764128 ] [ 1.39555 1.34846 1.39039 ] [ 0.152538 2.8802 2.74744 ] [ 1.52254 4.15487 3.86439 ] [ 2.76536 0.0171046 2.52424 ] [ 4.13989 1.28016 4.0502 ] [ 2.78466 2.66896 -0.17742 ] [ 4.2307 4.05829 1.13615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.13409e-12 -6.87251e-12 -7.641280000000001e-12 ] [ 1.39555e-10 1.34846e-10 1.39039e-10 ] [ 1.52538e-11 2.8802e-10 2.74744e-10 ] [ 1.52254e-10 4.15487e-10 3.864390000000001e-10 ] [ 2.76536e-10 1.71046e-12 2.52424e-10 ] [ 4.13989e-10 1.28016e-10 4.0502e-10 ] [ 2.78466e-10 2.66896e-10 -1.7742e-11 ] [ 4.2307e-10 4.058290000000001e-10 1.13615e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.0806894 1.6088785 -0.823757 ] [ -1.3101359 1.2401111 -2.1942491 ] [ -1.0566571 -1.4207938 -2.4737396 ] [ -0.9102635 0.8076036 2.2622502 ] [ 2.843598 0.1052675 0.5095902 ] [ -0.6123583 -0.4501496 -1.0807852 ] [ 0.2047222 -0.2807458 1.767693 ] [ -2.2395949 -1.6101714 2.0329974 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.935808573291478e-09 2.577707539644969e-09 -1.319804217493938e-09 ] [ -2.09906912634456e-09 1.986877027984037e-09 -3.515574637195529e-09 ] [ -1.692951315770201e-09 -2.276362628092069e-09 -3.963367785720506e-09 ] [ -1.458402910483059e-09 1.293923617454282e-09 3.624524410701827e-09 ] [ 4.555946272089132e-09 1.68657128819595e-10 8.164535113553868e-10 ] [ -9.811061598959622e-10 -7.212191709244463e-10 -1.731608793813017e-09 ] [ 3.280011253010747e-10 -4.498043608536371e-10 2.832156420685361e-09 ] [ -3.588226618405567e-09 -2.579778993815067e-09 3.257220931262751e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.045996 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.813899273645746e-18 } }